HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Staphylococcus aureus

External ID: CHEMBL4296184

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Target ChEMBL ID: CHEMBL352
ChEMBL Target Name: Staphylococcus aureus
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Data Source: CO-ADD Antimicrobial Screening

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
10	MIC	>	10000	nM	Median N= 2; Maxinhib 24.4 Pct
20	MIC	>	20000	nM	Median N= 2; Maxinhib -0.9 Pct
5	MIC	=	5000	nM	Median N= 2
	Inhibition	=	7.42	%	Average; N=2
0.0781	MIC	<=	78.1	nM	Median N= 2
	Inhibition	=	5.44	%	Average; N=2
	Inhibition	=	-0.36	%	Average; N=2
	Inhibition	=	-1.51	%	Average; N=2
	Inhibition	=	9.71	%	Average; N=2
20	MIC	>	20000	nM	Median N= 2; Maxinhib 6.2 Pct
10	MIC	>	10000	nM	Median N= 2; Maxinhib 14.7 Pct
	Inhibition	=	13.34	%	Average; N=2
	Inhibition	=	5.78	%	Average; N=2
	Inhibition	=	15.7	%	Average; N=2
20	MIC	>	20000	nM	Median N= 2; Maxinhib 11.5 Pct
5	MIC	=	5000	nM	Median N= 2
5	MIC	=	5000	nM	Median N= 2
	Inhibition	=	9.69	%	Average; N=2
2.5	MIC	=	2500	nM	Median N= 2; Range 5 - 2.5 Um
	Inhibition	=	12.6	%	Average; N=2

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Klebsiella pneumoniae

External ID: CHEMBL4296186

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Target ChEMBL ID: CHEMBL350
ChEMBL Target Name: Klebsiella pneumoniae
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Data Source: CO-ADD Antimicrobial Screening

Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment	Data Validity Comment
Inhibition	=	0.93	%	Average; N=2
Inhibition	=	16.87	%	Average; N=4
Inhibition	=	14.36	%	Average; N=4
Inhibition	=	8.63	%	Average; N=2
Inhibition	=	22.77	%	Average; N=2
MIC	>	32	ug.mL-1	Median N= 2; Maxinhib 12.7 Pct
Inhibition	=	-22.42	%	Average; N=2	Outside typical range
Inhibition	=	0.23	%	Average; N=4
MIC	>	32	ug.mL-1	Median N= 2; Maxinhib 20.1 Pct
Inhibition	=	10.23	%	Average; N=4
Inhibition	=	3.15	%	Average; N=4
Inhibition	=	7.81	%	Average; N=4
Inhibition	=	-10.52	%	Average; N=4	Outside typical range
MIC	>	32	ug.mL-1	Median N= 2; Maxinhib 19.8 Pct
Inhibition	=	7.19	%	Average; N=4
Inhibition	=	6.16	%	Average; N=2
Inhibition	=	11.98	%	Average; N=4
Inhibition	=	3.45	%	Average; N=2
Inhibition	=	3.96	%	Average; N=2
Inhibition	=	4.88	%	Average; N=2

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Escherichia coli

External ID: CHEMBL4296185

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Target ChEMBL ID: CHEMBL354
ChEMBL Target Name: Escherichia coli
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Data Source: CO-ADD Antimicrobial Screening

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
10	MIC	>	10000	nM	Median N= 2; Maxinhib 62.6 Pct
20	MIC	>	20000	nM	Median N= 2; Maxinhib 7.3 Pct
0.625	MIC	=	625	nM	Median N= 2
	Inhibition	=	3.55	%	Average; N=2
10	MIC	=	10000	nM	Median N= 2
	Inhibition	=	-0.79	%	Average; N=2
	Inhibition	=	-2.76	%	Average; N=2
	Inhibition	=	6.59	%	Average; N=2
	Inhibition	=	3.05	%	Average; N=2
20	MIC	>	20000	nM	Median N= 2; Maxinhib 8.1 Pct
10	MIC	>	10000	nM	Median N= 2; Maxinhib 17.5 Pct
	Inhibition	=	-6.11	%	Average; N=2
	Inhibition	=	3.59	%	Average; N=2
	Inhibition	=	-1.89	%	Average; N=2
20	MIC	>	20000	nM	Median N= 2; Maxinhib 7.5 Pct
1.25	MIC	=	1250	nM	Median N= 2; Range 2.5 - 1.25 Um
2.5	MIC	=	2500	nM	Median N= 2
	Inhibition	=	2.4	%	Average; N=2
5	MIC	=	5000	nM	Median N= 2; Range 10 - 5 Um
	Inhibition	=	-4.2	%	Average; N=2

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：RAW264.7

External ID: CHEMBL3062747

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2012
Volume: 21
Issue: 7
First Page: 1347
Last Page: 1352
DOI: 10.1007/s00044-011-9650-0

Target ChEMBL ID: CHEMBL612557
ChEMBL Target Name: RAW264.7
ChEMBL Target Type: CELL-LINE - Target is a specific cell-line
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Units	Activity Comment
Inhibition	%	Dose-dependent effect

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：RAW264.7

External ID: CHEMBL3062748

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2012
Volume: 21
Issue: 7
First Page: 1347
Last Page: 1352
DOI: 10.1007/s00044-011-9650-0

Target ChEMBL ID: CHEMBL612557
ChEMBL Target Name: RAW264.7
ChEMBL Target Type: CELL-LINE - Target is a specific cell-line
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Units	Activity Comment
Inhibition	%	Dose-dependent effect

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：KB

External ID: CHEMBL955283

Protocol: N/A

Comment: Journal: J Nat Prod
Year: 1982
Volume: 45
Issue: 4
First Page: 418
Last Page: 426
DOI: 10.1021/np50022a010

Target ChEMBL ID: CHEMBL398
ChEMBL Target Name: KB
ChEMBL Target Type: CELL-LINE - Target is a specific cell-line
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
ED50	=	4.3	ug ml-1
ED50	<	1	ug ml-1
ED50	=	2.3	ug ml-1
ED50	=	0.23	ug ml-1
ED50				Not Determined
ED50	=	0.36	ug ml-1
ED50	=	8.7	ug ml-1
ED50				Not Determined
ED50	=	3.9	ug ml-1
ED50	<	1	ug ml-1
ED50	<	0.25	ug ml-1
ED50	=	2.6	ug ml-1
ED50	=	10	ug ml-1
ED50	=	3.7	ug ml-1
ED50	>	100	ug ml-1
ED50	=	2.8	ug ml-1
ED50	=	0.013	ug ml-1
ED50	=	17	ug ml-1
ED50				Not Determined
ED50	=	8.9	ug ml-1

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：RAW264.7

External ID: CHEMBL3062749

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2012
Volume: 21
Issue: 7
First Page: 1347
Last Page: 1352
DOI: 10.1007/s00044-011-9650-0

Target ChEMBL ID: CHEMBL612557
ChEMBL Target Name: RAW264.7
ChEMBL Target Type: CELL-LINE - Target is a specific cell-line
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Activity Comment
Activity	Not Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：MEF

External ID: CHEMBL1069512

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Journal: Bioorg. Med. Chem.
Year: 2010
Volume: 18
Issue: 5
First Page: 1806
Last Page: 1815
DOI: 10.1016/j.bmc.2010.01.052

Target ChEMBL ID: CHEMBL614342
ChEMBL Target Name: MEF
ChEMBL Target Type: CELL-LINE - Target is a specific cell-line
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units
11.1	IC50	=	11100	nM

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：RAW264.7

External ID: CHEMBL3063264

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2012
Volume: 21
Issue: 7
First Page: 1347
Last Page: 1352
DOI: 10.1007/s00044-011-9650-0

Target ChEMBL ID: CHEMBL612557
ChEMBL Target Name: RAW264.7
ChEMBL Target Type: CELL-LINE - Target is a specific cell-line
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Units	Activity Comment
Inhibition	%	Dose-dependent effect

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：NON-PROTEIN TARGET

External ID: CHEMBL1069511

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Journal: Bioorg. Med. Chem.
Year: 2010
Volume: 18
Issue: 5
First Page: 1806
Last Page: 1815
DOI: 10.1016/j.bmc.2010.01.052

Target ChEMBL ID: CHEMBL3879801
ChEMBL Target Name: NON-PROTEIN TARGET
ChEMBL Target Type: NON-MOLECULAR - Target has not been defined at a molecular level, only the non-molecular entity which is affected (e.g., organism, cell line etc)
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units
0.0454	IC50	=	45.4	nM

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：RAW264.7

External ID: CHEMBL3063265

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2012
Volume: 21
Issue: 7
First Page: 1347
Last Page: 1352
DOI: 10.1007/s00044-011-9650-0

Target ChEMBL ID: CHEMBL612557
ChEMBL Target Name: RAW264.7
ChEMBL Target Type: CELL-LINE - Target is a specific cell-line
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Units	Activity Comment
Inhibition	%	Dose-dependent effect

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：NCGC 靶标：N/A

External ID: ATLMIPE3-IL2

Protocol: Plate log growing ED40515 -IL2 cells: 1000cells/ well in 5uL phenol red free RPMI +5% FBS +1x p/s, Glutamine using 1536 well white griener tissue culture plates and multidrop cassette acoustic dispensing Columns 1 and 3 DMSO Columns 2 and 4, 9.2 uM Bortezomib Incubate 48 hours for celltiter glo 37C with 5%CO2 and 95% humidity with low evaporation lids Dispense 3 uL per well of cell titer glo with multidrop Incubate for 15 minutes at RT Read on VL/2 using Luminesence Wheel (Filter A)

Comment: Compound Ranking:

1. Compounds are first classified as having full titration curves, partial modulation, partial curve (weaker actives), single point activity (at highest concentration only), or inactive. See data field "Curve Description". For this assay, apparent inhibitors are ranked higher than compounds that showed apparent activation.
2. For all inactive compounds, PUBCHEM_ACTIVITY_SCORE is 0. For all active compounds, a score range was given for each curve class type given above. Active compounds have PUBCHEM_ACTIVITY_SCORE between 40 and 100. Inconclusive compounds have PUBCHEM_ACTIVITY_SCORE between 1 and 39. Fit_LogAC50 was used for determining relative score and was scaled to each curve class' score range.

Phenotype	Potency	Efficacy	Curve_Description	Fit_LogAC50	Fit_HillSlope	Fit_R2	Fit_InfiniteActivity	Fit_ZeroActivity	Fit_CurveClass	Excluded_Points	Max_Response	Activity.at.0.0007804147.uM	Activity.at.0.00232.uM	Activity.at.0.00703.uM	Activity.at.0.021.uM	Activity.at.0.063.uM	Activity.at.0.190.uM	Activity.at.0.563.uM	Activity.at.1.709.uM	Activity.at.5.124.uM	Activity.at.15.37.uM	Activity.at.46.08.uM	Compound.QC
Inactive				-4.7292	3.0654	0.9623	9.547	110.4177	-2.1	0 0 0 0 0 0 0 0 0 0 0	5.6022	104.2237	100.4246	111.537	113.278	104.5883	115.9013	118.2206	116.1988	108.2862	72.5167	5.6022	QC'd by NCGCChem
Inactive									5		94.5792	97.6123	102.9478	99.8003	105.6959	101.965	105.2395	107.2333	115.1756	113.4024	96.8761	94.5792	QC'd by NCGCChem
Inactive									5		118.6862	122.5086	119.6416	121.4823	121.5344	119.0353	122.0707	119.7306	119.2832	118.9869	119.6097	118.6862	QC'd by Tocris
Activator	16.6261	35.2542	Partial curve; high efficacy	-4.7792	2.7202	0.9631	77.815	113.0692	-2.2	0 0 0 0 0 0 0 0 0 0 0	78.5161	113.5692	112.8167	111.4636	114.2791	108.5015	116.939	114.3917	112.9036	110.6506	97.9693	78.5161	QC'd by Tocris
Inactive	11.7704	16.4172	Complete curve; high efficacy; poor fit	-4.9292	4.9549	0.6619	95.8341	112.2513	4	0 0 0 0 0 0 0 0 0 0 0	95.4869	103.7513	106.3488	110.402	114.2577	113.5346	119.5724	112.7915	113.2464	116.1081	99.1816	95.4869	QC'd by Tocris
Inactive				-4.4292	4.9549	0.9697	-32.1898	108.8199	-3	0 0 0 0 0 0 0 0 0 0 0	1.164	105.3944	105.2818	103.0497	97.7276	115.3459	111.0574	111.7252	112.9196	115.2357	112.1339	1.164	QC'd by Tocris
Activator	29.5659	48.6071	Partial curve; high efficacy; poor fit	-4.5292	1.1	0.8239	64.4214	113.0285	-3	0 0 0 0 0 0 0 0 0 0 0	76.6898	115.0285	116.0876	115.7011	112.8082	115.8435	105.692	112.2303	104.9467	107.3798	105.466	76.6898	QC'd by Tocris
Activator	23.485	42.0328	Partial curve; high efficacy	-4.6292	4.095	0.9015	68.4355	110.4683	-3	0 0 0 0 0 0 0 0 0 0 0	72.122	113.3297	114.1347	103.636	115.0097	115.7355	111.7744	109.2314	106.9456	106.7162	103.8264	72.122	QC'd by Tocris
Inactive				-4.8792	2.2481	0.9696	2.8281	109.6245	-2.1	0 0 0 0 0 0 0 0 0 0 0	9.7496	96.0271	105.5671	105.6287	113.2706	112.4076	114.1956	118.5284	112.325	98.2876	45.4436	9.7496	QC'd by Tocris
Inactive				-4.6292	4.095	0.9799	7.2433	109.0947	-2.1	0 0 0 0 0 0 0 0 0 0 0	14.4101	103.9944	104.763	110.258	107.084	116.4146	111.9569	110.6255	112.9625	102.9255	93.5567	14.4101	QC'd by Tocris
Inactive				-5.7792	1.6436	0.9944	1.2985	114.9257	-1.1	0 0 0 0 0 0 0 0 0 0 0	0.8492	113.1907	113.1253	114.458	115.3332	116.5149	113.1099	102.9752	50.737	24.1576	1.8951	0.8492	QC'd by Tocris
Inactive	37.2212	30.4177	Partial curve; high efficacy; poor fit	-4.4292	4.9549	0.7237	77.1455	107.5632	4	0 0 0 0 0 0 0 0 0 0 0	83.8818	97.5632	107.1339	104.9893	111.5954	112.5168	105.1165	104.3329	111.0954	109.8131	110.136	83.8818	QC'd by Tocris
Activator	13.2066	33.5814	Complete curve; high efficacy	-4.8792	2.7868	0.954	67.0744	100.6558	-2.2	0 0 0 0 0 0 0 0 0 0 0	67.7547	98.6558	98.5706	96.727	103.9284	98.9821	101.4737	101.0657	104.9529	98.099	80.6702	67.7547	QC'd by Tocris
Inactive				-6.6792	1.8851	0.9861	31.7989	98.0488	-1.2	0 0 0 0 0 0 0 0 0 0 0	25.8415	95.1238	97.4305	94.2779	101.5923	96.6237	65.0954	39.5644	37.3052	31.266	35.2507	25.8415	QC'd by Tocris
Inactive	6.619	14.7923	Complete curve; high efficacy; poor fit	-5.1792	0.3	0.6009	102.0708	116.863	4	0 0 0 0 0 0 0 0 0 0 0	106.1195	116.363	115.8057	116.9704	115.3538	109.6889	110.0487	117.1565	112.8226	108.1773	109.0369	106.1195	QC'd by Tocris
Inactive				-5.6292	2.3332	0.9987	4.2257	115.9211	-1.1	0 0 0 0 0 0 0 0 0 0 0	4.4453	114.2356	114.2342	113.7348	116.5091	116.1485	116.8176	115.758	81.2658	18.5753	6.5629	4.4453	QC'd by Tocris
Activator	33.1734	98.5359	Partial curve; high efficacy	-4.4792	4.9549	0.9774	13.9975	112.5334	-3	0 0 0 0 0 0 0 0 0 0 0	30.1274	105.5334	110.0457	106.7691	113.3959	114.4372	114.0031	116.163	113.7765	118.176	111.2606	30.1274	QC'd by Tocris
Activator	14.818	75.9718	Complete curve; high efficacy	-4.8292	1.1	0.9552	39.2664	115.2383	-2.2	0 0 0 0 0 0 0 0 0 0 0	54.2185	115.5727	106.9415	117.026	115.8501	113.9337	117.563	115.9264	111.4945	90.2493	82.2031	54.2185	QC'd by SigmaAldrich
Inactive				-4.5792	4.095	0.9957	18.2481	117.382	-2.1	0 0 0 0 0 0 0 0 0 0 0	27.2239	118.8135	117.2814	121.5392	116.8542	117.5132	118.0112	115.2769	115.261	115.6537	107.0359	27.2239	QC'd by SigmaAldrich
Activator	14.818	86.1138	Complete curve; high efficacy	-4.8292	1.111	0.9589	23.8777	109.9915	-2.2	0 0 0 0 0 0 0 0 0 0 0	37.4536	105.3333	114.29	113.756	113.3396	109.4232	110.8614	101.714	94.8217	93.1227	70.3316	37.4536	QC'd by Tocris

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：NON-PROTEIN TARGET

External ID: CHEMBL1069510

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Journal: Bioorg. Med. Chem.
Year: 2010
Volume: 18
Issue: 5
First Page: 1806
Last Page: 1815
DOI: 10.1016/j.bmc.2010.01.052

Target ChEMBL ID: CHEMBL3879801
ChEMBL Target Name: NON-PROTEIN TARGET
ChEMBL Target Type: NON-MOLECULAR - Target has not been defined at a molecular level, only the non-molecular entity which is affected (e.g., organism, cell line etc)
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units
0.0322	IC50	=	32.2	nM

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：RAW264.7

External ID: CHEMBL3062382

Protocol: N/A

Comment: Journal: Med Chem Res
Year: 2012
Volume: 21
Issue: 7
First Page: 1347
Last Page: 1352
DOI: 10.1007/s00044-011-9650-0

Target ChEMBL ID: CHEMBL612557
ChEMBL Target Name: RAW264.7
ChEMBL Target Type: CELL-LINE - Target is a specific cell-line
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Activity Comment
Activity	Not Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：NCGC 靶标：N/A

External ID: ATLMIPE3+IL2

Protocol: Plate log growing ED40515 +IL2 cells: 1000cells/ well in 5uL phenol red free RPMI +5% FBS +1x p/s, Glutamine using 1536 well white griener tissue culture plates and multidrop cassette acoustic dispensing Columns 1 and 3 DMSO Columns 2 and 4, 9.2 uM Bortezomib Incubate 48 hours for celltiter glo 37C with 5%CO2 and 95% humidity with low evaporation lids Dispense 3 uL per well of cell titer glo with multidrop Incubate for 15 minutes at RT Read on VL/2 using Luminesence Wheel (Filter A)

Comment: Compound Ranking:

1. Compounds are first classified as having full titration curves, partial modulation, partial curve (weaker actives), single point activity (at highest concentration only), or inactive. See data field "Curve Description". For this assay, apparent inhibitors are ranked higher than compounds that showed apparent activation.
2. For all inactive compounds, PUBCHEM_ACTIVITY_SCORE is 0. For all active compounds, a score range was given for each curve class type given above. Active compounds have PUBCHEM_ACTIVITY_SCORE between 40 and 100. Inconclusive compounds have PUBCHEM_ACTIVITY_SCORE between 1 and 39. Fit_LogAC50 was used for determining relative score and was scaled to each curve class' score range.

Phenotype	Potency	Efficacy	Curve_Description	Fit_LogAC50	Fit_HillSlope	Fit_R2	Fit_InfiniteActivity	Fit_ZeroActivity	Fit_CurveClass	Excluded_Points	Max_Response	Activity.at.0.0007804147.uM	Activity.at.0.00232.uM	Activity.at.0.00703.uM	Activity.at.0.021.uM	Activity.at.0.063.uM	Activity.at.0.190.uM	Activity.at.0.563.uM	Activity.at.1.709.uM	Activity.at.5.124.uM	Activity.at.15.37.uM	Activity.at.46.08.uM	Compound.QC
Inactive				-4.5792	4.095	0.9352	-4.3862	109.5074	-2.1	0 0 0 0 0 0 0 0 0 0 0	5.937	111.2761	98.3538	98.465	113.252	123.8496	113.3665	116.477	112.5925	98.1032	98.4447	5.937	QC'd by NCGCChem
Activator	11.7704	45.2841	Complete curve; high efficacy; poor fit	-4.9292	4.9549	0.885	56.1472	101.4313	-1.2	0 0 0 0 0 0 0 0 0 0 0	56.3571	98.6875	92.6502	106.6305	95.4902	94.1041	106.3539	102.5622	111.4815	105.9599	65.5954	56.3571	QC'd by NCGCChem
Inactive	5.2576	7.9714	Complete curve; high efficacy; poor fit	-5.2792	4.9549	0.5799	104.8089	112.7802	4	0 0 0 0 0 0 0 0 0 0 0	105.5248	109.2802	112.5936	110.549	113.849	117.326	113.4703	108.6243	117.489	109.2587	103.8874	105.5248	QC'd by Tocris
Activator	16.6261	39.4408	Partial curve; high efficacy; poor fit	-4.7792	0.9	0.8337	72.5703	112.0111	-2.4	0 0 0 0 0 0 0 0 0 0 0	82.5605	112.5111	113.4956	121.1417	105.0674	108.5057	109.272	112.7382	103.3768	105.2406	93.2769	82.5605	QC'd by Tocris
Activator	18.6548	57.0548	Partial curve; high efficacy; poor fit	-4.7292	2.7202	0.8999	63.6367	120.6915	-2.4	1 0 0 0 0 0 0 0 0 0 0	63.6534	96.5211	111.8303	113.1657	129.2213	122.9369	123.2908	115.37	127.3088	120.0475	103.0856	63.6534	QC'd by Tocris
Inactive				-4.7792	1.6259	0.9244	-4.5062	101.4521	-2.1	0 0 0 0 0 0 0 0 0 0 0	2.9358	95.9604	109.3472	90.8183	96.3288	112.7692	106.4271	105.1395	96.7469	76.8171	63.166	2.9358	QC'd by Tocris
Inactive	23.485	29.6173	Partial curve; high efficacy; poor fit	-4.6292	0.7	0.5695	77.4424	107.0597	4	0 0 0 0 0 0 0 0 0 0 0	86.1287	109.5597	117.5503	99.3147	98.5473	105.9971	109.9309	105.2971	104.2988	95.0955	98.9368	86.1287	QC'd by Tocris
Activator	23.485	40.2773	Partial curve; high efficacy; poor fit	-4.6292	4.095	0.7984	70.4026	110.68	-3	0 0 0 0 0 0 0 0 0 0 0	72.5976	106.6248	107.3219	106.4059	115.6157	118.5966	121.4932	104.4615	104.329	110.372	104.7305	72.5976	QC'd by Tocris
Inactive				-4.7792	1.6259	0.9516	-1.0532	101.6122	-2.1	0 0 0 0 0 0 0 0 0 0 0	10.8027	95.4883	102.6574	98.0544	96.0111	102.9701	106.3913	108.3255	107.3181	76.4419	59.1711	10.8027	QC'd by Tocris
Inactive				-4.6292	4.095	0.95	0.0268	122.2908	-2.1	0 0 0 0 0 0 0 0 0 0 0	8.9436	120.4045	128.2196	116.7733	115.0651	128.2269	134.6948	123.3407	129.3396	106.379	101.6377	8.9436	QC'd by Tocris
Inactive				-5.8292	1.4781	0.9926	1.7631	115.4684	-1.1	0 0 0 0 0 0 0 0 0 0 0	1.3182	112.5244	119.0775	108.1682	115.9367	114.8247	116.7532	92.85	47.1523	22.4568	4.4444	1.3182	QC'd by Tocris
Activator	37.2212	45.7845	Partial curve; high efficacy; poor fit	-4.4292	4.9549	0.4816	74.268	120.0525	-3	0 0 0 0 0 0 0 0 0 0 0	85.8579	118.5757	109.4542	107.3883	117.9387	125.848	136.3214	108.9812	134.8503	111.2072	131.4753	85.8579	QC'd by Tocris
Activator	13.2066	34.5766	Complete curve; high efficacy; poor fit	-4.8792	1.9887	0.6902	60.5039	95.0804	-2.4	0 0 0 0 0 0 0 0 0 0 0	63.122	88.7124	91.1763	110.4826	89.3178	85.1688	103.9764	94.9952	96.7456	90.026	75.5809	63.122	QC'd by Tocris
Inactive				-5.2792	0.3	0.832	-12.5607	85.6461	-2.1	0 0 0 0 0 0 0 0 0 0 0	4.543	70.3264	80.9355	80.0013	80.1522	56.6257	54.0242	46.7117	46.5351	45.7459	40.5415	4.543	QC'd by Tocris
Inactive	23.485	36.0121	Partial curve; high efficacy; poor fit	-4.6292	0.8	0.5543	68.7625	104.7746	4	0 0 0 0 0 0 0 0 0 0 0	77.0979	108.7746	109.0309	91.9676	92.4091	104.0549	100.4498	105.7138	105.7176	100.3901	90.282	77.0979	QC'd by Tocris
Inactive				-5.8792	2.2481	0.9922	1.965	107.7516	-1.1	0 0 0 0 0 0 0 0 0 0 0	2.1552	97.2575	109.4244	107.9741	112.6201	109.9896	109.7183	90.798	40.8362	4.0195	5.4116	2.1552	QC'd by Tocris
Activator	18.6548	55.146	Partial curve; high efficacy; poor fit	-4.7292	4.9549	0.7915	54.9149	110.061	-2.2	0 0 0 0 0 0 0 0 0 0 0	55.5376	90.6652	103.4115	121.5092	113.2141	119.8898	110.116	116.6432	105.3547	108.7302	94.7519	55.5376	QC'd by Tocris
Activator	20.931	43.0304	Partial curve; high efficacy; poor fit	-4.6792	0.9	0.641	69.789	112.8194	-2.4	0 0 0 0 0 0 0 0 0 0 0	78.3524	109.8194	123.7532	113.5651	108.2166	121.7676	100.6265	104.9798	113.1934	97.726	102.6574	78.3524	QC'd by SigmaAldrich
Activator	16.6261	62.0849	Partial curve; high efficacy; poor fit	-4.7792	3.132	0.7841	56.6644	118.7492	-2.2	0 0 0 0 0 0 0 0 0 0 0	59.7172	115.8345	125.8537	110.4091	113.4045	109.6999	127.2107	106.2518	141.4232	118.8299	90.6116	59.7172	QC'd by SigmaAldrich
Inactive				-5.4792	0.7	0.9755	-1.2029	113.2151	-1.1	0 0 0 0 0 0 0 0 0 0 0	16.2535	112.1677	112.6262	120.9954	107.7288	94.5815	97.49	96.0671	69.1097	43.3255	27.3099	16.2535	QC'd by Tocris

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：N/A

External ID: CHEMBL1069509

Protocol: N/A

Comment: Journal: Bioorg Med Chem
Year: 2010
Volume: 18
Issue: 5
First Page: 1806
Last Page: 1815
DOI: 10.1016/j.bmc.2010.01.052

Standard Type	Standard Text Value
solubility	Insoluble

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：NON-PROTEIN TARGET

External ID: CHEMBL1069519

Protocol: N/A

Comment: Journal: Bioorg. Med. Chem.
Year: 2010
Volume: 18
Issue: 5
First Page: 1806
Last Page: 1815
DOI: 10.1016/j.bmc.2010.01.052

Target ChEMBL ID: CHEMBL3879801
ChEMBL Target Name: NON-PROTEIN TARGET
ChEMBL Target Type: NON-MOLECULAR - Target has not been defined at a molecular level, only the non-molecular entity which is affected (e.g., organism, cell line etc)
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Activity Comment
Activity	Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：NON-PROTEIN TARGET

External ID: CHEMBL1069518

Protocol: N/A

Comment: Journal: Bioorg. Med. Chem.
Year: 2010
Volume: 18
Issue: 5
First Page: 1806
Last Page: 1815
DOI: 10.1016/j.bmc.2010.01.052

Target ChEMBL ID: CHEMBL3879801
ChEMBL Target Name: NON-PROTEIN TARGET
ChEMBL Target Type: NON-MOLECULAR - Target has not been defined at a molecular level, only the non-molecular entity which is affected (e.g., organism, cell line etc)
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Activity Comment
Activity	Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：NON-PROTEIN TARGET

External ID: CHEMBL1069515

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Journal: Bioorg. Med. Chem.
Year: 2010
Volume: 18
Issue: 5
First Page: 1806
Last Page: 1815
DOI: 10.1016/j.bmc.2010.01.052

Target ChEMBL ID: CHEMBL3879801
ChEMBL Target Name: NON-PROTEIN TARGET
ChEMBL Target Type: NON-MOLECULAR - Target has not been defined at a molecular level, only the non-molecular entity which is affected (e.g., organism, cell line etc)
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units
0.044	IC50	=	44	nM

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：NON-PROTEIN TARGET

External ID: CHEMBL1069514

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Journal: Bioorg. Med. Chem.
Year: 2010
Volume: 18
Issue: 5
First Page: 1806
Last Page: 1815
DOI: 10.1016/j.bmc.2010.01.052

Target ChEMBL ID: CHEMBL3879801
ChEMBL Target Name: NON-PROTEIN TARGET
ChEMBL Target Type: NON-MOLECULAR - Target has not been defined at a molecular level, only the non-molecular entity which is affected (e.g., organism, cell line etc)
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units
0.05	IC50	=	50	nM

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：N/A

External ID: CHEMBL1069513

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Journal: Bioorg. Med. Chem.
Year: 2010
Volume: 18
Issue: 5
First Page: 1806
Last Page: 1815
DOI: 10.1016/j.bmc.2010.01.052

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units
11.4	IC50	=	11400	nM

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：N/A

External ID: CHEMBL923297

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Standard Type	Activity Comment
Activity	Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：NCGC 靶标：N/A

External ID: OBG420

Protocol: Assay Protocol Summary:

1,000 cells in 4 uL of media were dispensed into white, solid bottom 1536-well plates using a Multidrop Combi (Thermo Scientific). The Assay plates were incubated for 16 hours at 37 C with 5% CO2 in assay plates, followed by the addition of 23 nL of DMSO or drug dissolved in DMSO. Each compound was assayed in five concentrations (0.092, 0.46, 2.3, 11.5, and 57.5 uM), using the automated Wako 1536 Pin Tool workstation and incubated at 37 C with 5% CO2 48 hours. 4 uL of ATPlite, the ATP monitoring reagent, was then added to the each well of the assay plates using the Multidrop Combi reagent dispenser followed by incubation for 15 minutes at room temperature. The resulting luminescence was measured using the ViewLux plate reader.

Comment: Compound Ranking:

1. Compounds are first classified as having full titration curves, partial modulation, partial curve (weaker actives), single point activity (at highest concentration only), or inactive. See data field "Curve Description". For this assay, cytotoxic compounds are considered active and show up as apparent inhibitors, which are ranked higher than compounds that showed apparent activation.
2. For all inactive compounds, PUBCHEM_ACTIVITY_SCORE is 0. For all active compounds, a score range was given for each curve class type given above. Active compounds have PUBCHEM_ACTIVITY_SCORE between 40 and 100. Inconclusive compounds have PUBCHEM_ACTIVITY_SCORE between 1 and 39. Fit_LogAC50 was used for determining relative score and was scaled to each curve class' score range.

Phenotype	Potency	Efficacy	Fit_LogAC50	Fit_HillSlope	Fit_R2	Fit_InfiniteActivity	Fit_ZeroActivity	Fit_CurveClass	Excluded_Points	Max_Response	Activity at 0.051 uM	Activity at 0.256 uM	Activity at 1.283 uM	Activity at 6.551 uM	Activity at 25.26 uM	Activity at 38.52 uM	Panel ID	Panel Name
Inactive	0.0891	20.4377	-7.05	4.9549	0.5243	16	-4.4377	4	0 0 0 0 0	13.1195	-1.6147	23.0221	4.9232	22.4364		13.1195	3	PA-1
Inactive	0.5012	19.512	-6.3	4.5045	0.9837	2.5	-17.012	4	0 0 0 0 0	4.6148	-17.0933	-15.139	2.0203	0.9631		4.6148	4	SKOV3
Inactive	0.0891	10.1784	-7.05	4.9549	0.4664	-7.6784	2.5	4	0 0 0 0 0	-7.2247	0.9983	-11.3986	-10.48	-0.961		-7.2247	5	C33A
Inactive		0				0	0	4		6.8018	-1.7943	7.9288	7.7169	7.1557		6.8018	6	JEG-3
Inactive	0.631	5.8754	-6.2	4.9549	0.6533	5	-0.8754	4	0 0 0 0 0	4.9978	0.7404	-1.9795	8.0951	2.3607		4.9978	7	Es-2
Inactive		0				0	0	4		-1.5659	2.9339	-4.8958	-4.7951	1.5969		-1.5659	8	Hek293T
Inactive	0.0891	9.995	-7.05	4.9549	0.3786	-7.495	2.5	4	0 0 0 0 0	-5.4128	1.1477	-11.5205	-0.3743	-12.9125		-5.4128	9	Tov112D
Inactive		0				0	0	4		-3.2957	3.8308	1.4062	-4.436	-2.7163		-3.2957	10	Tov-21-G
Inactive	0.7079	14.6604	-6.15	4.9549	0.9994	11.5	-3.1604	4	0 0 0 0 1	1.8313	-3.0503	-3.0355	11.1111	11.2024		1.8313	11	OV90
Inactive	2.5119	11.0392	-5.6	1.6259	0.9918	4.5	-6.5392	4	0 0 0 0 0	4.3244	-5.7563	-6.6993	-3.0441	3.0217		4.3244	12	CASKI
Inactive		0				0	0	4		4.0002	9.2609	1.7307	16.1689	8.2706	4.0002		1	CAOV3
Inactive	0.1	12.4224	-7	1.6436	0.8881	-1.9224	10.5	4	0 0 0 0 0	-4.5186	7.7607	0.4819	-0.6217	-0.7957	-4.5186		2	HeLa
Inactive		0				0	0	4		9.027	13.2513	1.7412	13.5275	17.6857	9.027		3	PA-1
Inactive	0.3162	18	-6.5	4.4495	0.9637	7	25	4	0 0 0 0 1	19.6871	25.2034	21.5131	5.0173	9.4271	19.6871		4	SKOV3
Inactive		0				0	0	4		0.3369	0.4452	-0.9125	5.7292	4.44	0.3369		5	C33A
Inactive	0.0631	10.5	-7.2	4.9549	0.8451	2	12.5	4	0 0 0 0 0	1.0879	10.8386	0.1902	2.4619	4.6395	1.0879		6	JEG-3
Inactive	0.5012	9.5598	-6.3	4.9549	0.9517	0	-9.5598	4	0 0 0 0 0	-0.0179	-8.4158	-10.4665	0.9667	-1.2439	-0.0179		7	Es-2
Inactive	0.0631	14.8119	-7.2	4.9549	0.534	-5.8119	9	4	0 0 0 0 1	0.2814	6.5861	-12.7599	1.4268	-6.0897	0.2814		8	Hek293T
Inactive	8.9125	8.541	-5.05	4.045	0.614	8	-0.541	4	0 0 0 0 0	7.7519	3.7595	-4.2009	-0.5734	0.6635	7.7519		9	Tov112D
Inactive		0				0	0	4		1.0625	-0.4666	0.2533	-1.2691	-7.1333	1.0625		10	Tov-21-G

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：N/A

External ID: CHEMBL923296

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Standard Type	Activity Comment
Activity	Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：N/A

External ID: CHEMBL923299

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Standard Type	Activity Comment
Activity	Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Severe acute respiratory syndrome coronavirus 2

External ID: CHEMBL4303805

Protocol: N/A

Comment: Target ChEMBL ID: CHEMBL4303835
ChEMBL Target Name: SARS-CoV-2
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Data Source: SARS-CoV-2 Screening Data

Standard Type	Standard Relation	Standard Value	Standard Units	Data Validity Comment
Inhibition	=	-11.52	%	Outside typical range
Inhibition	=	5.09	%
Inhibition	=	-1.71	%
Inhibition	=	3.69	%
Inhibition	=	22.47	%
Inhibition	=	8.51	%
Inhibition	=	-6.86	%
Inhibition	=	-6.18	%
Inhibition	=	-2.07	%
Inhibition	=	3.91	%
Inhibition	=	-5.9	%
Inhibition	=	-2.45	%
Inhibition	=	-5.55	%
Inhibition	=	6.31	%
Inhibition	=	-1.08	%
Inhibition	=	12.7	%
Inhibition	=	0.37	%
Inhibition	=	8.88	%
Inhibition	=	11.63	%
Inhibition	=	-1.96	%

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：N/A

External ID: CHEMBL923298

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Standard Type	Activity Comment
Activity	Not Evaluated

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：NON-PROTEIN TARGET

External ID: CHEMBL922297

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Target ChEMBL ID: CHEMBL3879801
ChEMBL Target Name: NON-PROTEIN TARGET
ChEMBL Target Type: NON-MOLECULAR - Target has not been defined at a molecular level, only the non-molecular entity which is affected (e.g., organism, cell line etc)
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
Activity	>	90	%

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：NON-PROTEIN TARGET

External ID: CHEMBL922296

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Target ChEMBL ID: CHEMBL3879801
ChEMBL Target Name: NON-PROTEIN TARGET
ChEMBL Target Type: NON-MOLECULAR - Target has not been defined at a molecular level, only the non-molecular entity which is affected (e.g., organism, cell line etc)
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Activity Comment
Activity	Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：NON-PROTEIN TARGET

External ID: CHEMBL923295

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Target ChEMBL ID: CHEMBL3879801
ChEMBL Target Name: NON-PROTEIN TARGET
ChEMBL Target Type: NON-MOLECULAR - Target has not been defined at a molecular level, only the non-molecular entity which is affected (e.g., organism, cell line etc)
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
Activity	>	80	%

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：NON-PROTEIN TARGET

External ID: CHEMBL923294

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Target ChEMBL ID: CHEMBL3879801
ChEMBL Target Name: NON-PROTEIN TARGET
ChEMBL Target Type: NON-MOLECULAR - Target has not been defined at a molecular level, only the non-molecular entity which is affected (e.g., organism, cell line etc)
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
Activity	>	50	%

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Mus musculus

External ID: CHEMBL923305

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Target ChEMBL ID: CHEMBL375
ChEMBL Target Name: Mus musculus
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Activity Comment
Activity	Non-toxic

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Mus musculus

External ID: CHEMBL923304

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Target ChEMBL ID: CHEMBL375
ChEMBL Target Name: Mus musculus
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Activity Comment
Activity	Toxic

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Mus musculus

External ID: CHEMBL923307

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Target ChEMBL ID: CHEMBL375
ChEMBL Target Name: Mus musculus
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Activity Comment
Activity	Not Evaluated

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Mus musculus

External ID: CHEMBL923306

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Target ChEMBL ID: CHEMBL375
ChEMBL Target Name: Mus musculus
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Activity Comment
Activity	Not Evaluated

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Acinetobacter baumannii

External ID: CHEMBL4296188

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Target ChEMBL ID: CHEMBL614425
ChEMBL Target Name: Acinetobacter baumannii
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Data Source: CO-ADD Antimicrobial Screening

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
10	MIC	>	10000	nM	Median N= 2; Maxinhib 10.4 Pct
20	MIC	>	20000	nM	Median N= 2; Maxinhib 10.3 Pct
5	MIC	=	5000	nM	Median N= 2
	Inhibition	=	22.02	%	Average; N=2
10	MIC	>	10000	nM	Median N= 2; Maxinhib 7.2 Pct
	Inhibition	=	0.29	%	Average; N=2
	Inhibition	=	13.44	%	Average; N=2
	Inhibition	=	15.75	%	Average; N=2
	Inhibition	=	30.31	%	Average; N=2
20	MIC	>	20000	nM	Median N= 2; Maxinhib 19.9 Pct
10	MIC	>	10000	nM	Median N= 2; Maxinhib 13.5 Pct
	Inhibition	=	12.68	%	Average; N=2
	Inhibition	=	8.04	%	Average; N=2
	Inhibition	=	21.28	%	Average; N=2
20	MIC	>	20000	nM	Median N= 2; Maxinhib 17.6 Pct
10	MIC	>	10000	nM	Median N= 2; Maxinhib 10.9 Pct
20	MIC	>	20000	nM	Median N= 2; Maxinhib 24.8 Pct
	Inhibition	=	19.94	%	Average; N=2
10	MIC	>	10000	nM	Median N= 2; Maxinhib 15.2 Pct
	Inhibition	=	19.7	%	Average; N=2

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：N/A

External ID: CHEMBL923301

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Standard Type	Activity Comment
Activity	Not Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Pseudomonas aeruginosa

External ID: CHEMBL4296187

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Target ChEMBL ID: CHEMBL348
ChEMBL Target Name: Pseudomonas aeruginosa
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Data Source: CO-ADD Antimicrobial Screening

Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment	Data Validity Comment
Inhibition	=	10.84	%	Average; N=1
Inhibition	=	14.55	%	Average; N=1
Inhibition	=	-13.46	%	Average; N=1	Outside typical range
Inhibition	=	21.47	%	Average; N=2
Inhibition	=	32.07	%	Average; N=1
Inhibition	=	2.27	%	Average; N=1
Inhibition	=	-21.74	%	Average; N=1	Outside typical range
Inhibition	=	9.41	%	Average; N=1
Inhibition	=	19.34	%	Average; N=1
Inhibition	=	-25.08	%	Average; N=1	Outside typical range
Inhibition	=	9.21	%	Average; N=4
Inhibition	=	15.98	%	Average; N=4
Inhibition	=	8.03	%	Average; N=1
Inhibition	=	-1.26	%	Average; N=1
Inhibition	=	6.81	%	Average; N=1
Inhibition	=	-8.48	%	Average; N=1
Inhibition	=	25.25	%	Average; N=1
Inhibition	=	44.67	%	Average; N=1
Inhibition	=	1.69	%	Average; N=1
Inhibition	=	2.93	%	Average; N=1

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：N/A

External ID: CHEMBL923300

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Standard Type	Activity Comment
Activity	Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Cryptococcus neoformans

External ID: CHEMBL4296190

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Target ChEMBL ID: CHEMBL365
ChEMBL Target Name: Cryptococcus neoformans
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Data Source: CO-ADD Antimicrobial Screening

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment	Data Validity Comment
10	MIC	>	10000	nM	Median N= 2; Maxinhib 9.6 Pct
	Inhibition	=	-7.36	%	Average; N=2; Conc=25 Um ;
20	MIC	>	20000	nM	Median N= 2; Maxinhib 17.1 Pct
10	MIC	>	10000	nM	Median N= 2; Maxinhib 6.5 Pct
	Inhibition	=	-5.61	%	Average; N=2
10	MIC	>	10000	nM	Median N= 2; Maxinhib 7.2 Pct
	Inhibition	=	-0.18	%	Average; N=2
	Inhibition	=	-8.54	%	Average; N=2
	Inhibition	=	-5.03	%	Average; N=2
	Inhibition	=	-1.5	%	Average; N=2
20	MIC	>	20000	nM	Median N= 2; Maxinhib 8.8 Pct
0.1563	MIC	=	156.3	nM	Median N= 2
	Inhibition	=	-9.6	%	Average; N=2; Conc=25 Um ;
	Inhibition	=	-0.09	%	Average; N=2
	Inhibition	=	-3.07	%	Average; N=2
	Inhibition	=	-2.97	%	Average; N=2
20	MIC	>	20000	nM	Median N= 2; Maxinhib 9.3 Pct
	Inhibition	=	-12.66	%	Average; N=2; Conc=25 Um ;	Outside typical range
10	MIC	>	10000	nM	Median N= 2; Maxinhib 4.5 Pct
20	MIC	>	20000	nM	Median N= 2; Maxinhib 9.3 Pct

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：N/A

External ID: CHEMBL923303

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Standard Type	Activity Comment
Activity	Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Candida albicans

External ID: CHEMBL4296189

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Target ChEMBL ID: CHEMBL366
ChEMBL Target Name: Candida albicans
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Data Source: CO-ADD Antimicrobial Screening

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
10	MIC	>	10000	nM	Median N= 2; Maxinhib 3.0 Pct
	Inhibition	=	8.04	%	Average; N=2; Conc=25 Um ;
20	MIC	>	20000	nM	Median N= 2; Maxinhib 7.4 Pct
10	MIC	>	10000	nM	Median N= 2; Maxinhib 4.8 Pct
	Inhibition	=	3.92	%	Average; N=2
10	MIC	>	10000	nM	Median N= 2; Maxinhib 10.4 Pct
	Inhibition	=	-0.23	%	Average; N=2
	Inhibition	=	0.3	%	Average; N=2
	Inhibition	=	-0.48	%	Average; N=2
	Inhibition	=	2.62	%	Average; N=2
20	MIC	>	20000	nM	Median N= 2; Maxinhib 8.0 Pct
0.0781	MIC	<=	78.1	nM	Median N= 2
	Inhibition	=	-3.39	%	Average; N=2; Conc=25 Um ;
	Inhibition	=	5.22	%	Average; N=2
	Inhibition	=	3.37	%	Average; N=2
	Inhibition	=	4.56	%	Average; N=2
20	MIC	>	20000	nM	Median N= 2; Maxinhib 3.4 Pct
	Inhibition	=	-0.73	%	Average; N=2; Conc=25 Um ;
10	MIC	>	10000	nM	Median N= 2; Maxinhib 7.9 Pct
20	MIC	>	20000	nM	Median N= 2; Maxinhib 1.4 Pct

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：N/A

External ID: CHEMBL923302

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Standard Type	Activity Comment
Activity	Not Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Mus musculus

External ID: CHEMBL922393

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Target ChEMBL ID: CHEMBL375
ChEMBL Target Name: Mus musculus
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Activity Comment
Activity	Active

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：HepG2

External ID: CHEMBL5303715

Protocol: N/A

Comment: Compounds with activity <= 10uM or explicitly reported as active by ChEMBL are flagged as active in this PubChem assay presentation.

Target ChEMBL ID: CHEMBL395
ChEMBL Target Name: HepG2
ChEMBL Target Type: CELL-LINE - Target is a specific cell-line
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Data Source: EU-OPENSCREEN

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
2.8	IC50 relative	=	2800	nM	Active
8.5	IC50 relative	=	8500	nM	Active
8.2	IC50 relative	=	8200	nM	Active
8.7	IC50 relative	=	8700	nM	Active
15	IC50 relative	=	15000	nM	Inactive
1.1	IC50 relative	=	1100	nM	Active
8.3	IC50 relative	=	8300	nM	Active
7.8	IC50 relative	=	7800	nM	Active
5.3	IC50 relative	=	5300	nM	Active
4.5	IC50 relative	=	4500	nM	Active
2.5	IC50 relative	=	2500	nM	Active
12.5	IC50 relative	=	12500	nM	Inactive
1	IC50 relative	=	1000	nM	Active
0.7	IC50 relative	=	700	nM	Active
3.6	IC50 relative	=	3600	nM	Active
2.7	IC50 relative	=	2700	nM	Active
13.1	IC50 relative	=	13100	nM	Active
1.9	IC50 relative	=	1900	nM	Active
11.8	IC50 relative	=	11800	nM	Inactive
50	IC50 relative	=	50000	nM	Inactive

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Mus musculus

External ID: CHEMBL922392

Protocol: N/A

Comment: Journal: Proc. Natl. Acad. Sci. U.S.A.
Year: 2007
Volume: 104
Issue: 11
First Page: 4389
Last Page: 4394
DOI: 10.1073/pnas.0700499104

Target ChEMBL ID: CHEMBL375
ChEMBL Target Name: Mus musculus
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Activity Comment
Activity	Not Evaluated

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：NCGC 靶标：Luciferase [Photinus pyralis]

External ID: FLUC100

Protocol: NCGC Assay Protocol Summary:

Reagents: 50mM Tris acetate, pH 7.5; 10mM Mg acetate; 10uM D-luciferin (Sigma #L9504); 10uM ATP; 0.01% Tween-20; 0.05% BSA; 10nM P. pyralis luciferase (Sigma #L9506)
Control compounds used were two known firefly luciferase inhibitors (compounds (2) and (5) in Auld et al., 2010), and DMSO.

Assay Summary:
Three microliters containing firefly luciferase substrates in buffer (final concentrations: 50mM Tris acetate, pH 7.5, 10mM Mg acetate, 0.01% Tween-20, 0.05% BSA, 10uM D-luciferin, and 10uM ATP) are dispensed into each well of a Greiner white, solid-bottom 1536-well format plate using a flying reagent dispenser (FRD). These assay plates were then treated with 23nL of compound or DMSO using a Kalypsys pin tool, which allows for delivery of a 6-point interplate titration of each compound to the assay plate (quantitative HTS), with a final compound concentrations ranging from approximately 60muM to 7pM. One microliter of firefly luciferase in 500mM Tris-acetate buffer was then delivered by FRD to each well for a final enzyme concentration of 10nM. Luciferase activity was then measured using a ViewLux CCD imager (PerkinElmer), with an average exposure time of 2-30 seconds (2X binning, medium/high gain).

Keywords: NIH Roadmap, MLPCN, MLSMR, qHTS, miR-21, firefly luciferase, FLuc, miRNA.

Comment: Compound Ranking:

1. Compounds are first classified as having full titration curves, partial modulation, partial curve (weaker actives), single point activity (at highest concentration only), or inactive. See data field "Curve Description". For this assay, apparent inhibitors are ranked higher than compounds that showed apparent activation.
2. For all inactive compounds, PUBCHEM_ACTIVITY_SCORE is 0. For all active compounds, a score range was given for each curve class type given above. Active compounds have PUBCHEM_ACTIVITY_SCORE between 40 and 100. Inconclusive compounds have PUBCHEM_ACTIVITY_SCORE between 1 and 39. Fit_LogAC50 was used for determining relative score and was scaled to each curve class' score range.

Phenotype	Potency	Efficacy	Curve_Description	Fit_LogAC50	Fit_HillSlope	Fit_R2	Fit_InfiniteActivity	Fit_ZeroActivity	Fit_CurveClass	Excluded_Points	Max_Response	Activity at 0.00368 uM	Activity at 0.092 uM	Activity at 0.460 uM	Activity at 2.300 uM	Activity at 11.50 uM	Activity at 57.50 uM	Compound QC
Inactive									4		0.644	1.422	0.841	6.7312	0.9199	0.7976	0.644	QC'd by "DPISMR"
Inactive									4		2.3435	2.1521	2.9689	2.7416	2.8472	0.4111	2.3435	QC'd by "DPISMR"
Inactive									4		0.0015	0.3102	-2.0273	1.3352	0.1332	-0.3094	0.0015	QC'd by "DPISMR"
Inactive									4	0 0 0 0 0 0	-0.1716	1.865	2.0294	6.4476	2.3796	1.0274	-0.1716	QC'd by "DPISMR"
Inactive									4	0 0 0 0 0 0	1.007	-2.7011	-0.1708	6.4991	2.0041	2.0967	1.007	QC'd by "DPISMR"
Inactive									4	0 0 0 0 0 0	-1.1179	0.2049	6.1966	-2.3909	-2.1607	3.3301	-1.1179	QC'd by "DPISMR"
Inactive									4		1.0949	2.8758	2.7284	1.683	2.3968	1.1492	1.0949	QC'd by "Enamine"
Inactive									4		11.7061	14.5237	13.6692	3.9103	14.4002	15.0123	11.7061	QC'd by "DPISMR"
Inactive									4		-0.8885	1.6365	3.5919	1.1642	3.1773	0.4167	-0.8885	QC'd by "Enamine"
Inactive									4		1.4599	-0.538	2.5346	2.3752	3.3567	0.7721	1.4599	QC'd by "DPISMR"
Inactive									4		-0.0427	1.2187	1.9255	1.5493	2.9677	0.0419	-0.0427	QC'd by "DPISMR"
Inhibitor	37.933	35.7734	Partial curve; partial efficacy; poor fit	-4.421	4.9549	0.9772	-33.7734	2	-2.4	0 0 0 0 0 0	-29.8112	0.9245	5.218	-0.1723	1.0843	3.5778	-29.8112	QC'd by "DPISMR"
Inactive									4	0 0 0 0 0 0	-8.1569	1.3366	0.0372	1.4317	2.1732	-0.2051	-8.1569	QC'd by "DPISMR"
Inactive									4	0 0 0 0 0 0	-2.0656	0.9492	2.3965	1.2731	1.4874	4.6957	-2.0656	QC'd by "DPISMR"
Inactive									4		0.7593	1.3159	1.7201	1.7134	1.9314	3.1668	0.7593	QC'd by "DPISMR"
Inactive									4		0.76	2.9569	4.6913	4.9933	3.6857	2.5801	0.76	QC'd by "DPISMR"
Inhibitor	26.8545	26.7655	Partial curve; partial efficacy; poor fit	-4.571	4.5045	0.9889	-26.7655	0	-2.4	0 0 0 0 0 0	-26.0546	-0.3971	1.531	0.1508	-1.9239	-0.6216	-26.0546	QC'd by "Enamine"
Inactive									4		1.7276	0.5936	2.4796	2.8662	2.8768	1.6972	1.7276	QC'd by "DPISMR"
Inactive									4		-0.1439	-1.2403	0.0246	-0.2502	1.0119	-0.5561	-0.1439	QC'd by "DPISMR"
Inactive									4	0 0 0 0 0 0	-3.3497	0.6868	2.3313	-0.2471	1.6909	-0.0071	-3.3497	QC'd by "DPISMR"

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Caenorhabditis elegans

External ID: CHEMBL4271282

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2017
Volume: 142
First Page: 229
Last Page: 243
DOI: 10.1016/j.ejmech.2017.07.043

Target ChEMBL ID: CHEMBL613135
ChEMBL Target Name: Caenorhabditis elegans
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
ILS	=	20	%

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：Caenorhabditis elegans

External ID: CHEMBL4271292

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2017
Volume: 142
First Page: 229
Last Page: 243
DOI: 10.1016/j.ejmech.2017.07.043

Target ChEMBL ID: CHEMBL613135
ChEMBL Target Name: Caenorhabditis elegans
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

Standard Type	Standard Relation	Standard Value	Standard Units
ILS	=	20	%

HepG2 Cytotoxicity Assay Measured in Cell-Based System Using Plate Reader - 7071-02_Inhibitor_Dose_DryPowder_Activity_Set16

来源：ChEMBL 靶标：N/A

External ID: CHEMBL4271293

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2017
Volume: 142
First Page: 229
Last Page: 243
DOI: 10.1016/j.ejmech.2017.07.043

Standard Type	Standard Relation	Standard Value	Standard Units	Data Validity Comment
Solubility	=	17	ug.mL-1
Solubility	=	61000	ug.mL-1	Outside typical range

38748-32-2 靶点实验数据