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: CHEMBL3789855

Protocol: N/A

Comment: Journal: Eur. J. Med. Chem.
Year: 2016
Volume: 114
First Page: 209
Last Page: 219
DOI: 10.1016/j.ejmech.2016.03.008

Standard Type	Standard Relation	Standard Value
FC	=	2
FC	=	10
FC	=	3
FC	=	4
FC	=	4
FC	=	2
FC	=	2
FC	=	3
FC	=	2
FC	=	5
FC	=	6
FC	=	10
FC	=	3
FC	=	12
FC	=	6
FC	=	10
FC	=	2
FC	=	7
FC	=	5
FC	=	8

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: CHEMBL3789854

Protocol: N/A

Comment: Journal: Eur. J. Med. Chem.
Year: 2016
Volume: 114
First Page: 209
Last Page: 219
DOI: 10.1016/j.ejmech.2016.03.008

Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
MHC	=	10	ug
MHC	=	50	ug
MHC	=	15	ug
MHC	=	20	ug
MHC	=	20	ug
MHC	=	10	ug
MHC				Not Active
MHC	=	10	ug
MHC	=	15	ug
MHC	=	10	ug
MHC	=	25	ug
MHC	=	30	ug
MHC				Not Active
MHC	=	50	ug
MHC	=	15	ug
MHC				Not Active
MHC	=	60	ug
MHC	=	30	ug
MHC	=	50	ug
MHC	=	10	ug

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: CHEMBL4004947

Protocol: N/A

Comment: Journal: J Nat Prod
Year: 2017
Volume: 80
Issue: 1
First Page: 114
Last Page: 125
DOI: 10.1021/acs.jnatprod.6b00759

Standard Type	Standard Units	Activity Comment
Inhibition	%	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：N/A

External ID: CHEMBL3789853

Protocol: N/A

Comment: Journal: Eur. J. Med. Chem.
Year: 2016
Volume: 114
First Page: 209
Last Page: 219
DOI: 10.1016/j.ejmech.2016.03.008

Standard Type	Standard Relation	Standard Value
FC	=	3.2
FC	=	1
FC	=	3.2
FC	=	3.2
FC	=	3.2
FC	=	3.2
FC	=	1
FC	=	1
FC	=	1
FC	=	2.1
FC	=	1
FC	=	3.2
FC	=	1
FC	=	1
FC	=	2.1
FC	=	3.2
FC	=	2.1
FC	=	1
FC	=	2.1
FC	=	3.2

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: CHEMBL3789852

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2016
Volume: 114
First Page: 209
Last Page: 219
DOI: 10.1016/j.ejmech.2016.03.008

Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
LD50				Not Active
LD50	=	9	ug
LD50	=	3	ug
LD50				Not Active
LD50	=	9	ug
LD50				Not Active
LD50				Not Active
LD50				Not Active
LD50	=	9	ug
LD50				Not Active
LD50				Not Active
LD50	=	9	ug
LD50				Not Active
LD50	=	9	ug
LD50				Not Active
LD50				Not Active
LD50	=	3	ug
LD50	=	3	ug
LD50	=	3	ug
LD50	=	6	ug

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

来源：ChEMBL 靶标：Myeloperoxidase

External ID: CHEMBL3877132

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: ACS Med Chem Lett
Year: 2017
Volume: 8
Issue: 2
First Page: 206
Last Page: 210
DOI: 10.1021/acsmedchemlett.6b00417

Target ChEMBL ID: CHEMBL2439
ChEMBL Target Name: Myeloperoxidase
ChEMBL Target Type: SINGLE PROTEIN - Target is a single protein chain
Relationship Type: D - Direct protein target assigned
Confidence: Direct single protein target assigned

Standard Type	Standard Relation	Standard Value	Standard Units
Inhibition	=	61	%
Inhibition
Inhibition
Inhibition
Inhibition
Inhibition
Inhibition
Inhibition
Inhibition
Inhibition
Inhibition
Inhibition
Inhibition	=	61	%
Inhibition
Inhibition
Inhibition
Inhibition
Inhibition
Inhibition
Inhibition

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: CHEMBL3789859

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2016
Volume: 114
First Page: 209
Last Page: 219
DOI: 10.1016/j.ejmech.2016.03.008

Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
LD50				Not Active
LD50	=	10	ug
LD50				Not Active
LD50				Not Active
LD50	=	10	ug
LD50				Not Active
LD50				Not Active
LD50				Not Active
LD50				Not Active
LD50				Not Active
LD50				Not Active
LD50	=	10	ug
LD50				Not Active
LD50	=	10	ug
LD50				Not Active
LD50				Not Active
LD50				Not Active
LD50				Not Active
LD50	=	8	ug
LD50				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：N/A

External ID: CHEMBL3789858

Protocol: N/A

Comment: Journal: Eur. J. Med. Chem.
Year: 2016
Volume: 114
First Page: 209
Last Page: 219
DOI: 10.1016/j.ejmech.2016.03.008

Standard Type	Standard Relation	Standard Value
FC	=	3.75
FC	=	1.25
FC	=	3.75
FC	=	2.5
FC	=	3.75
FC	=	1.25
FC	=	3.75
FC	=	1.25
FC	=	1.25
FC	=	2.5
FC	=	2.5
FC	=	1.25
FC	=	2.5
FC	=	2.5
FC	=	2.5
FC	=	3.75
FC	=	3.75
FC	=	1.25
FC	=	2.5
FC	=	3.75

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: CHEMBL3789857

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2016
Volume: 114
First Page: 209
Last Page: 219
DOI: 10.1016/j.ejmech.2016.03.008

Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
LD50				Not Active
LD50	=	150	ug
LD50	=	50	ug
LD50				Not Active
LD50	=	150	ug
LD50				Not Active
LD50				Not Active
LD50				Not Active
LD50	=	100	ug
LD50				Not Active
LD50				Not Active
LD50	=	150	ug
LD50	=	50	ug
LD50	=	150	ug
LD50				Not Active
LD50				Not Active
LD50	=	50	ug
LD50	=	50	ug
LD50	=	100	ug
LD50	=	100	ug

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

来源：ChEMBL 靶标：MDA-MB-231

External ID: CHEMBL4004946

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: J Nat Prod
Year: 2017
Volume: 80
Issue: 1
First Page: 114
Last Page: 125
DOI: 10.1021/acs.jnatprod.6b00759

Target ChEMBL ID: CHEMBL400
ChEMBL Target Name: MDA-MB-231
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
2.1	IC50	=	2100	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: CHEMBL3789856

Protocol: N/A

Comment: Journal: Eur. J. Med. Chem.
Year: 2016
Volume: 114
First Page: 209
Last Page: 219
DOI: 10.1016/j.ejmech.2016.03.008

Standard Type	Standard Relation	Standard Value
LogP	=	1.24
LogP	=	0.97
LogP	=	2.39
LogP	=	1.15
LogP	=	1.48
LogP	=	1.87
LogP	=	1.76
LogP	=	1.47
LogP	=	1.44
LogP	=	1.15
LogP	=	1.48
LogP	=	1.48
LogP	=	1.47
LogP	=	3.19
LogP	=	1.19
LogP	=	1.47
LogP	=	2
LogP	=	1.15
LogP	=	1.19
LogP	=	1.15

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: CHEMBL3789862

Protocol: N/A

Comment: Journal: Eur. J. Med. Chem.
Year: 2016
Volume: 114
First Page: 209
Last Page: 219
DOI: 10.1016/j.ejmech.2016.03.008

Standard Type	Standard Relation	Standard Value
FC	=	2
FC	=	2
FC	=	2
FC	=	2
FC	=	1
FC	=	1
FC	=	1
FC	=	1
FC	=	2
FC	=	3
FC	=	1
FC	=	2
FC	=	2
FC	=	1
FC	=	4
FC	=	3
FC	=	1
FC	=	1
FC	=	3
FC	=	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: CHEMBL3789861

Protocol: N/A

Comment: Journal: Eur. J. Med. Chem.
Year: 2016
Volume: 114
First Page: 209
Last Page: 219
DOI: 10.1016/j.ejmech.2016.03.008

Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
MHC	=	10	ug
MHC	=	10	ug
MHC	=	10	ug
MHC	=	10	ug
MHC	=	5	ug
MHC	=	5	ug
MHC				Not Active
MHC	=	5	ug
MHC	=	5	ug
MHC	=	10	ug
MHC	=	15	ug
MHC	=	5	ug
MHC	=	10	ug
MHC	=	10	ug
MHC	=	5	ug
MHC				Not Active
MHC	=	20	ug
MHC	=	15	ug
MHC	=	5	ug
MHC	=	5	ug

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

来源：ChEMBL 靶标：Meloidogyne incognita

External ID: CHEMBL3078556

Protocol: N/A

Comment: Journal: J Agric Food Chem
Year: 2013
Volume: 61
Issue: 8
First Page: 1794
Last Page: 1803
DOI: 10.1021/jf305164m

Target ChEMBL ID: CHEMBL613453
ChEMBL Target Name: Meloidogyne incognita
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	Data Validity Comment
EC50	=	75	ug.mL-1	Outside typical range
EC50	>	1000	ug.mL-1	Outside typical range
EC50	>	250	ug.mL-1	Outside typical range
EC50	>	500	ug.mL-1	Outside typical range
EC50	>	250	ug.mL-1	Outside typical range
EC50	>	1000	ug.mL-1	Outside typical range
EC50	=	11	ug.mL-1
EC50	=	11	ug.mL-1
EC50	=	120	ug.mL-1	Outside typical range
EC50	=	8	ug.mL-1
EC50	>	1000	ug.mL-1	Outside typical range
EC50	>	1000	ug.mL-1	Outside typical range
EC50	=	4	ug.mL-1
EC50	=	31	ug.mL-1
EC50	>	1000	ug.mL-1	Outside typical range
EC50	=	44	ug.mL-1
EC50	=	12	ug.mL-1
EC50	>	1000	ug.mL-1	Outside typical range
EC50	=	72	ug.mL-1	Outside typical range
EC50	>	1000	ug.mL-1	Outside typical range

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

来源：ChEMBL 靶标：Meloidogyne incognita

External ID: CHEMBL3078557

Protocol: N/A

Comment: Journal: J Agric Food Chem
Year: 2013
Volume: 61
Issue: 8
First Page: 1794
Last Page: 1803
DOI: 10.1021/jf305164m

Target ChEMBL ID: CHEMBL613453
ChEMBL Target Name: Meloidogyne incognita
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
EC100	=	500	mg/L
EC100	>	1000	mg/L
EC100	>	100	mg/L
EC100	>	500	mg/L
EC100	>	250	mg/L
EC100	>	1000	mg/L
EC100	>	25	mg/L
EC100	>	50	mg/L
EC100	>	200	mg/L
EC100	=	11	mg/L
EC100	>	1000	mg/L
EC100	>	1000	mg/L
EC100	>	20	mg/L
EC100	>	250	mg/L
EC100	>	1000	mg/L
EC100	>	100	mg/L
EC100	>	20	mg/L
EC100	>	1000	mg/L
EC100	>	250	mg/L
EC100	>	1000	mg/L

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: CHEMBL891104

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: 2007
Volume: 15
Issue: 5
First Page: 2006
Last Page: 2015
DOI: 10.1016/j.bmc.2006.12.038

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Data Validity Comment
39810700	IC50	=	3.981071705535E10	nM	Outside typical range
5750	IC50	=	5750000	nM	Outside typical range
173780000	IC50	=	1.7378008287494E11	nM	Outside typical range
3120	IC50	=	3120000	nM	Outside typical range
323594000	IC50	=	3.2359365692963E11	nM	Outside typical range
50500	IC50	=	50500000	nM	Outside typical range
19952600	IC50	=	1.995262314969E10	nM	Outside typical range
14200	IC50	=	14200000	nM	Outside typical range
70794600	IC50	=	7.079457843841E10	nM	Outside typical range
16250	IC50	=	16250000	nM	Outside typical range
61659500	IC50	=	6.165950018615E10	nM	Outside typical range
5900	IC50	=	5900000	nM	Outside typical range
169824000	IC50	=	1.6982436524617E11	nM	Outside typical range
5550	IC50	=	5550000	nM	Outside typical range
181970000	IC50	=	181970085861	nM	Outside typical range
42880	IC50	=	42880000	nM	Outside typical range
23442300	IC50	=	2.34422881532E10	nM	Outside typical range
13300	IC50	=	13300000	nM	Outside typical range
75857800	IC50	=	7.585775750292E10	nM	Outside typical range
29500	IC50	=	29500000	nM	Outside typical range

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: CHEMBL3789851

Protocol: N/A

Comment: Journal: Eur. J. Med. Chem.
Year: 2016
Volume: 114
First Page: 209
Last Page: 219
DOI: 10.1016/j.ejmech.2016.03.008

Standard Type	Standard Relation	Standard Value
FC	=	11.2
FC	=	2.6
FC	=	9.8
FC	=	11.2
FC	=	9.8
FC	=	9.8
FC	=	2.6
FC	=	2.6
FC	=	2.6
FC	=	8
FC	=	2.1
FC	=	9.8
FC	=	2.1
FC	=	4.9
FC	=	4.9
FC	=	11.2
FC	=	8
FC	=	2.6
FC	=	8
FC	=	9.8

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: CHEMBL3789850

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2016
Volume: 114
First Page: 209
Last Page: 219
DOI: 10.1016/j.ejmech.2016.03.008

Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment
LD50				Not Active
LD50	=	25	ug
LD50	=	6	ug
LD50				Not Active
LD50	=	22	ug
LD50				Not Active
LD50				Not Active
LD50				Not Active
LD50	=	25	ug
LD50				Not Active
LD50				Not Active
LD50	=	22	ug
LD50				Not Active
LD50	=	22	ug
LD50				Not Active
LD50				Not Active
LD50	=	6	ug
LD50	=	6	ug
LD50	=	6	ug
LD50	=	18	ug

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

来源：ChEMBL 靶标：Plasmodium falciparum

External ID: CHEMBL4004935

Protocol: N/A

Comment: Journal: J Nat Prod
Year: 2017
Volume: 80
Issue: 1
First Page: 114
Last Page: 125
DOI: 10.1021/acs.jnatprod.6b00759

Target ChEMBL ID: CHEMBL364
ChEMBL Target Name: Plasmodium falciparum
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
GI	=	25	%
GI	=	95	%

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: CHEMBL1110735

Protocol: N/A

Comment: Journal: Bioorg Med Chem Lett
Year: 2009
Volume: 19
Issue: 17
First Page: 4952
Last Page: 4957
DOI: 10.1016/j.bmcl.2009.07.082

Standard Type	Activity Comment
Activity	Not Active
Activity	Not Active
Activity	Active
Activity	Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Active
Activity	Not Active
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：N/A

External ID: CHEMBL1110734

Protocol: N/A

Comment: Journal: Bioorg Med Chem Lett
Year: 2009
Volume: 19
Issue: 17
First Page: 4952
Last Page: 4957
DOI: 10.1016/j.bmcl.2009.07.082

Standard Type	Activity Comment
Activity	Not Active
Activity	Not Active
Activity	Active
Activity	Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Not Active
Activity	Active
Activity	Not Active
Activity	Not Active

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

来源：DTP/NCI 靶标：N/A

External ID: MCF7_OneDose

Protocol: NCI-60 Human Tumor Cell Lines Screen was performed using the standard one-dose NCI protocol, which is described in more detail at https://dtp.cancer.gov/discovery_development/nci-60/default.htm.

Compounds with GIPRCNT values below 10 were considered active. Activity score was based on GIPRCNT using the following formula:
max(-GIPRCNT/2 + 50, 0)
Score is 0 for GIPRCNT values of 100 or above, 50 for GIPRCNT values of 0, and 100 for GIPRCNT values of -100.

Comment: These data are a subset of the data from the NCI human tumor cell line screen. Compounds are identified by the NCI National Service Center (NSC) number, which is contained in the
PUBCHEM_EXT_DATASOURCE_REGID field. In the NCI cell line identification system, MCF7 is panel number 5, cell number 1. PANELCODE or PANELNAME identify the NCI-60 cell panel. PANELNBR does NOT identify the NCI-60 panel.

EXPID is the NCI internal tracking number for the experiment identifier, and PREFIX = 'S' for the NSCs submitted through the NCI Chemical Agents repository.

Substance concentration unit is indicated in the data table, using the following abbreviations: M = molar (M), u = micrograms/milliliter (microg/mL), V = volumetric fraction.

M_GIPRCNT represents the mean growth percent for that experiment, and N_GIPRCNT indicates the number of values for that NSC within an experiment, while STDEV_GIPRCNT is the standard deviation. Most NSCs are tested once per experiment, resulting in EXP_COUNT = 1.

EXPID	PREFIX	CONCENTRATION_UNIT	CONCENTRATION	PANELNBR	CELLNBR	PANELNAME	CELLNAME	PANELCODE	M_GIPRCNT	N_GIPRCNT	EXP_COUNT
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	88.231	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	87.1119	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	14.4371	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	89.7113	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	97.2463	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	90.0129	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	85.7031	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	30.8539	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	14.2896	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	85.8526	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	83.1036	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	84.2194	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	89.3237	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	85.6034	1	1
2106OS49	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	89.6643	1	1
2106OS52	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	91.2503	1	1
2106OS52	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	94.8714	1	1
2106OS52	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	93.7372	1	1
2106OS52	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	112.6132	1	1
2106OS52	S	M	1.0E-5	5	1	Breast Cancer	MCF7	BRE	73.375	1	1

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

来源：ChEMBL 靶标：U138-MG

External ID: CHEMBL4190671

Protocol: N/A

Comment: Journal: MedChemComm
Year: 2016
Volume: 7
Issue: 11
First Page: 2167
Last Page: 2176
DOI: 10.1039/C6MD00425C

Target ChEMBL ID: CHEMBL4296506
ChEMBL Target Name: U138-MG
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	=	30	%

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

来源：DTP/NCI 靶标：N/A

External ID: IGROV1_OneDose

Protocol: NCI-60 Human Tumor Cell Lines Screen was performed using the standard one-dose NCI protocol, which is described in more detail at https://dtp.cancer.gov/discovery_development/nci-60/default.htm.

Compounds with GIPRCNT values below 10 were considered active. Activity score was based on GIPRCNT using the following formula:
max(-GIPRCNT/2 + 50, 0)
Score is 0 for GIPRCNT values of 100 or above, 50 for GIPRCNT values of 0, and 100 for GIPRCNT values of -100.

Comment: These data are a subset of the data from the NCI human tumor cell line screen. Compounds are identified by the NCI National Service Center (NSC) number, which is contained in the
PUBCHEM_EXT_DATASOURCE_REGID field. In the NCI cell line identification system, IGROV1 is panel number 6, cell number 10. PANELCODE or PANELNAME identify the NCI-60 cell panel. PANELNBR does NOT identify the NCI-60 panel.

EXPID is the NCI internal tracking number for the experiment identifier, and PREFIX = 'S' for the NSCs submitted through the NCI Chemical Agents repository.

Substance concentration unit is indicated in the data table, using the following abbreviations: M = molar (M), u = micrograms/milliliter (microg/mL), V = volumetric fraction.

M_GIPRCNT represents the mean growth percent for that experiment, and N_GIPRCNT indicates the number of values for that NSC within an experiment, while STDEV_GIPRCNT is the standard deviation. Most NSCs are tested once per experiment, resulting in EXP_COUNT = 1.

EXPID	PREFIX	CONCENTRATION_UNIT	CONCENTRATION	PANELNBR	CELLNBR	PANELNAME	CELLNAME	PANELCODE	M_GIPRCNT	N_GIPRCNT	EXP_COUNT
0809OS51	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	89.6274	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	94.0185	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	77.1805	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	76.1686	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	82.5618	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	88.7561	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	83.5845	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	92.7497	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	70.9555	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	58.7306	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	72.6041	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	90.3839	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	110.2345	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	97.6538	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	93.7697	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	56.4618	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	80.8893	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	79.078	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	-20.3008	1	1
0810OS71	S	M	1.0E-5	6	10	Ovarian Cancer	IGROV1	OVA	72.0949	1	1

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

来源：ChEMBL 靶标：C6

External ID: CHEMBL4190672

Protocol: N/A

Comment: Journal: MedChemComm
Year: 2016
Volume: 7
Issue: 11
First Page: 2167
Last Page: 2176
DOI: 10.1039/C6MD00425C

Target ChEMBL ID: CHEMBL614657
ChEMBL Target Name: C6
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	=	30	%

Standard Type	Standard Relation	Standard Value
FC	=	2
FC	=	10
FC	=	3
FC	=	4
FC	=	4
FC	=	2
FC	=	2
FC	=	3
FC	=	2
FC	=	5
FC	=	6
FC	=	10
FC	=	3
FC	=	12
FC	=	6
FC	=	10
FC	=	2
FC	=	7
FC	=	5
FC	=	8

Standard Type	Standard Relation	Standard Value
FC	=	3.2
FC	=	1
FC	=	3.2
FC	=	3.2
FC	=	3.2
FC	=	3.2
FC	=	1
FC	=	1
FC	=	1
FC	=	2.1
FC	=	1
FC	=	3.2
FC	=	1
FC	=	1
FC	=	2.1
FC	=	3.2
FC	=	2.1
FC	=	1
FC	=	2.1
FC	=	3.2

Standard Type	Standard Relation	Standard Value
FC	=	2
FC	=	2
FC	=	2
FC	=	2
FC	=	1
FC	=	1
FC	=	1
FC	=	1
FC	=	2
FC	=	3
FC	=	1
FC	=	2
FC	=	2
FC	=	1
FC	=	4
FC	=	3
FC	=	1
FC	=	1
FC	=	3
FC	=	2

Standard Type	Standard Relation	Standard Value
FC	=	2
FC	=	10
FC	=	3
FC	=	4
FC	=	4
FC	=	2
FC	=	2
FC	=	3
FC	=	2
FC	=	5
FC	=	6
FC	=	10
FC	=	3
FC	=	12
FC	=	6
FC	=	10
FC	=	2
FC	=	7
FC	=	5
FC	=	8

Standard Type	Standard Relation	Standard Value
FC	=	3.2
FC	=	1
FC	=	3.2
FC	=	3.2
FC	=	3.2
FC	=	3.2
FC	=	1
FC	=	1
FC	=	1
FC	=	2.1
FC	=	1
FC	=	3.2
FC	=	1
FC	=	1
FC	=	2.1
FC	=	3.2
FC	=	2.1
FC	=	1
FC	=	2.1
FC	=	3.2

Standard Type	Standard Relation	Standard Value
FC	=	2
FC	=	2
FC	=	2
FC	=	2
FC	=	1
FC	=	1
FC	=	1
FC	=	1
FC	=	2
FC	=	3
FC	=	1
FC	=	2
FC	=	2
FC	=	1
FC	=	4
FC	=	3
FC	=	1
FC	=	1
FC	=	3
FC	=	2

100-83-4 靶点实验数据

Standard Type	Standard Relation	Standard Value
FC	=	2
FC	=	10
FC	=	3
FC	=	4
FC	=	4
FC	=	2
FC	=	2
FC	=	3
FC	=	2
FC	=	5
FC	=	6
FC	=	10
FC	=	3
FC	=	12
FC	=	6
FC	=	10
FC	=	2
FC	=	7
FC	=	5
FC	=	8

Standard Type	Standard Relation	Standard Value
FC	=	3.2
FC	=	1
FC	=	3.2
FC	=	3.2
FC	=	3.2
FC	=	3.2
FC	=	1
FC	=	1
FC	=	1
FC	=	2.1
FC	=	1
FC	=	3.2
FC	=	1
FC	=	1
FC	=	2.1
FC	=	3.2
FC	=	2.1
FC	=	1
FC	=	2.1
FC	=	3.2

Standard Type	Standard Relation	Standard Value
FC	=	2
FC	=	2
FC	=	2
FC	=	2
FC	=	1
FC	=	1
FC	=	1
FC	=	1
FC	=	2
FC	=	3
FC	=	1
FC	=	2
FC	=	2
FC	=	1
FC	=	4
FC	=	3
FC	=	1
FC	=	1
FC	=	3
FC	=	2