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

来源：ChEMBL 靶标：Human alphaherpesvirus 1

External ID: CHEMBL694222

Protocol: N/A

Comment: Journal: J Med Chem
Year: 1984
Volume: 27
Issue: 11
First Page: 1416
Last Page: 1421
DOI: 10.1021/jm00377a007

Target ChEMBL ID: CHEMBL377
ChEMBL Target Name: Human alphaherpesvirus 1
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
MIC50	=	7	ug.mL-1
MIC50	=	320	ug.mL-1
MIC50	=	13.8	ug.mL-1
MIC50	=	59	ug.mL-1
MIC50	=	10	ug.mL-1
MIC50	=	4.7	ug.mL-1
MIC50	=	0.3	ug.mL-1
MIC50	=	93	ug.mL-1
MIC50	<	32	ug.mL-1
MIC50	=	68	ug.mL-1
MIC50	=	205	ug.mL-1
MIC50	=	9	ug.mL-1
MIC50	=	2.8	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：Human rhinovirus 1A

External ID: CHEMBL800916

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 1989
Volume: 32
Issue: 4
First Page: 746
Last Page: 756
DOI: 10.1021/jm00124a005

Target ChEMBL ID: CHEMBL613760
ChEMBL Target Name: Human rhinovirus 1A
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
Rating	=	0
Rating	=	0.8
Rating	=	0.1
Rating	=	0.7
Rating	=	0
Rating	=	0.2
Rating	=	0
Rating	=	1

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

来源：ChEMBL 靶标：Human alphaherpesvirus 2

External ID: CHEMBL696293

Protocol: N/A

Comment: Journal: J Med Chem
Year: 1989
Volume: 32
Issue: 4
First Page: 746
Last Page: 756
DOI: 10.1021/jm00124a005

Target ChEMBL ID: CHEMBL370
ChEMBL Target Name: Human alphaherpesvirus 2
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
Rating	=	1.19
Rating	=	1.25
Rating	=	0.2
Rating	=	1.4
Rating	=	1
Rating	=	0
Rating	=	0.12
Rating	=	1.06

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

来源：ChEMBL 靶标：Zika virus

External ID: CHEMBL4337947

Protocol: N/A

Comment: Journal: J Nat Prod
Year: 2019
Volume: 82
Issue: 10
First Page: 2721
Last Page: 2730
DOI: 10.1021/acs.jnatprod.9b00251

Target ChEMBL ID: CHEMBL4296612
ChEMBL Target Name: Zika virus
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
log10 TCID50	=	5.4

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

来源：ChEMBL 靶标：Human alphaherpesvirus 1

External ID: CHEMBL877527

Protocol: N/A

Comment: Journal: J Med Chem
Year: 1984
Volume: 27
Issue: 11
First Page: 1416
Last Page: 1421
DOI: 10.1021/jm00377a007

Target ChEMBL ID: CHEMBL377
ChEMBL Target Name: Human alphaherpesvirus 1
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
Virus rating	=	2
Virus rating	=	1.3
Virus rating	=	0.8
Virus rating	=	2.9
Virus rating	=	1.7
Virus rating	=	1.6
Virus rating	=	4.6
Virus rating	=	0.6
Virus rating	=	1.8
Virus rating	=	0.8
Virus rating	=	1.5
Virus rating	=	2.2
Virus rating	=	3.5

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

来源：ChEMBL 靶标：Human respirovirus 3

External ID: CHEMBL762072

Protocol: N/A

Comment: Journal: J Med Chem
Year: 1989
Volume: 32
Issue: 4
First Page: 746
Last Page: 756
DOI: 10.1021/jm00124a005

Target ChEMBL ID: CHEMBL613126
ChEMBL Target Name: Human respirovirus 3
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
Rating	=	1.3
Rating	=	2.2
Rating	=	1.4
Rating	=	1.3
Rating	=	0.08
Rating	=	1.2
Rating	=	0.68
Rating	=	0.8

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

来源：ChEMBL 靶标：Eimeria tenella

External ID: CHEMBL674773

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 1982
Volume: 25
Issue: 1
First Page: 32
Last Page: 35
DOI: 10.1021/jm00343a007

Target ChEMBL ID: CHEMBL612854
ChEMBL Target Name: Eimeria tenella
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
MEC	>	50	mg l-1
MEC	>	20	mg l-1
MEC	=	20	mg l-1
MEC	>	20	mg l-1
MEC	=	5	mg l-1
MEC	>	20	mg l-1
MEC	>	20	mg l-1
MEC	=	0.31	mg l-1
MEC	=	1.25	mg l-1
MEC	=	20	mg l-1
MEC	>	20	mg l-1
MEC	>	20	mg l-1

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-related coronavirus

External ID: CHEMBL887577

Protocol: N/A

Comment: Journal: Bioorg Med Chem Lett
Year: 2007
Volume: 17
Issue: 9
First Page: 2470
Last Page: 2473
DOI: 10.1016/j.bmcl.2007.02.026

Target ChEMBL ID: CHEMBL4303836
ChEMBL Target Name: SARS-CoV
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Data Validity Comment
300	IC50	>	300000	nM	Outside typical range
300	IC50	>	300000	nM	Outside typical range
300	IC50	>	300000	nM	Outside typical range
300	IC50	>	300000	nM	Outside typical range
300	IC50	>	300000	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：Erythroleukemia cell line

External ID: CHEMBL681343

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 Med Chem
Year: 1985
Volume: 28
Issue: 10
First Page: 1481
Last Page: 1485
DOI: 10.1021/jm00148a018

Target ChEMBL ID: CHEMBL614155
ChEMBL Target Name: Erythroleukemia cell line
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
7000	ID50	>	7	mM
2000	ID50	>	2	mM
4000	ID50	>	4	mM
7000	ID50	>	7	mM
7000	ID50	>	7	mM
5000	ID50	>	5	mM
1600	ID50	=	1.6	mM
860	ID50	=	0.86	mM
8000	ID50	>	8	mM
5000	ID50	>	5	mM
540	ID50	=	0.54	mM
6000	ID50	=	6	mM

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

来源：ChEMBL 靶标：Human adenovirus 2

External ID: CHEMBL641423

Protocol: N/A

Comment: Journal: J Med Chem
Year: 1989
Volume: 32
Issue: 4
First Page: 746
Last Page: 756
DOI: 10.1021/jm00124a005

Target ChEMBL ID: CHEMBL613715
ChEMBL Target Name: Human adenovirus 2
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
Rating	=	0.2
Rating	=	0
Rating	=	0
Rating	=	0.3
Rating	=	0
Rating	=	0
Rating	=	0
Rating	=	0.2

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

来源：ChEMBL 靶标：Erythroleukemia cell line

External ID: CHEMBL676668

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 1985
Volume: 28
Issue: 10
First Page: 1481
Last Page: 1485
DOI: 10.1021/jm00148a018

Target ChEMBL ID: CHEMBL614155
ChEMBL Target Name: Erythroleukemia cell line
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
Differentiation	=	3	%
Differentiation	=	70	%
Differentiation	=	4	%
Differentiation	=	51	%
Differentiation	=	51	%
Differentiation	=	12	%
Differentiation	=	1	%
Differentiation	=	82	%
Differentiation	=	1	%
Differentiation	=	1	%
Differentiation	=	56	%
Differentiation	=	1	%
Differentiation	=	49	%
Differentiation	=	74	%

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

来源：ChEMBL 靶标：Erythroleukemia cell line

External ID: CHEMBL681345

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. Med. Chem.
Year: 1985
Volume: 28
Issue: 10
First Page: 1481
Last Page: 1485
DOI: 10.1021/jm00148a018

Target ChEMBL ID: CHEMBL614155
ChEMBL Target Name: Erythroleukemia cell line
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
5	Optimal concentration	=	0.005	mM
7000	Optimal concentration	=	7	mM
1000	Optimal concentration	=	1	mM
4000	Optimal concentration	=	4	mM
7000	Optimal concentration	=	7	mM
7000	Optimal concentration	=	7	mM
4000	Optimal concentration	=	4	mM
1600	Optimal concentration	=	1.6	mM
500	Optimal concentration	=	0.5	mM
8000	Optimal concentration	=	8	mM
5000	Optimal concentration	=	5	mM
200	Optimal concentration	=	0.2	mM
2000	Optimal concentration	=	2	mM

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: CHEMBL631377

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 2001
Volume: 44
Issue: 15
First Page: 2490
Last Page: 2497
DOI: 10.1021/jm0100990

Standard Type	Standard Relation	Standard Value
LogD	=	0.4
LogD	=	2.4
LogD	=	2.79
LogD	=	-0.16
LogD	=	0.97
LogD	=	5.07
LogD	=	0.63
LogD	=	2.06
LogD	=	1.26
LogD	=	0.35
LogD	=	3.13
LogD	=	2.98
LogD	=	-1.35
LogD	=	3.34
LogD	=	0.23
LogD	=	3.38
LogD	=	1.28
LogD	=	1.71
LogD	=	-0.61
LogD	=	2.04

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

来源：ChEMBL 靶标：Vero

External ID: CHEMBL821095

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 1982
Volume: 25
Issue: 11
First Page: 1334
Last Page: 1338
DOI: 10.1021/jm00353a012

Target ChEMBL ID: CHEMBL391
ChEMBL Target Name: Vero
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
Virus rating	=	1.7

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: CHEMBL631379

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 2000
Volume: 43
Issue: 15
First Page: 2922
Last Page: 2928
DOI: 10.1021/jm0000822

Standard Type	Standard Relation	Standard Value
Log k'w	=	2.63
Log k'w	=	4.16
Log k'w	=	4.13
Log k'w	=	1.56
Log k'w	=	2.21
Log k'w	=	-0.31
Log k'w	=	1.11
Log k'w	=	1.31
Log k'w	=	3.06
Log k'w	=	4.37
Log k'w	=	2.4
Log k'w	=	0.16
Log k'w	=	1.21
Log k'w	=	1.18
Log k'w	=	1.54
Log k'w	=	3.34
Log k'w	=	2.49
Log k'w	=	2.54
Log k'w	=	0.1
Log k'w	=	3.4

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

来源：ChEMBL 靶标：Equilibrative nucleoside transporter 1

External ID: CHEMBL936364

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: 2008
Volume: 16
Issue: 7
First Page: 3848
Last Page: 3865
DOI: 10.1016/j.bmc.2008.01.044

Target ChEMBL ID: CHEMBL1997
ChEMBL Target Name: Equilibrative nucleoside transporter 1
ChEMBL Target Type: SINGLE PROTEIN - Target is a single protein chain
Relationship Type: H - Homologous protein target assigned
Confidence: Homologous single protein target assigned

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Data Validity Comment
1.69824	IC50	=	1698.24	nM
77.6247	IC50	=	77624.71	nM
229.087	IC50	=	229086.77	nM	Outside typical range
0.02138	IC50	=	21.38	nM
32.3594	IC50	=	32359.37	nM
0.22387	IC50	=	223.87	nM
0.81283	IC50	=	812.83	nM
120.226	IC50	=	120226.44	nM	Outside typical range
2.88403	IC50	=	2884.03	nM
0.33113	IC50	=	331.13	nM
389.045	IC50	=	389045.14	nM	Outside typical range
331.131	IC50	=	331131.12	nM	Outside typical range
34.6737	IC50	=	34673.69	nM
0.25119	IC50	=	251.19	nM
57.544	IC50	=	57543.99	nM
0.81283	IC50	=	812.83	nM
63.0957	IC50	=	63095.73	nM
0.02754	IC50	=	27.54	nM
0.33113	IC50	=	331.13	nM
0.28184	IC50	=	281.84	nM

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

来源：ChEMBL 靶标：Vero

External ID: CHEMBL821099

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 1982
Volume: 25
Issue: 11
First Page: 1334
Last Page: 1338
DOI: 10.1021/jm00353a012

Target ChEMBL ID: CHEMBL391
ChEMBL Target Name: Vero
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
Virus rating	=	2.2

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

来源：ChEMBL 靶标：Bacillus anthracis

External ID: CHEMBL925842

Protocol: N/A

Comment: Journal: J. Biol. Chem.
Year: 2007
Volume: 282
Issue: 16
First Page: 12112
Last Page: 12118
DOI: 10.1074/jbc.m611432200

Target ChEMBL ID: CHEMBL613904
ChEMBL Target Name: Bacillus anthracis
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 Active
Activity	Not Active
Activity	Not 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：Vaccinia virus

External ID: CHEMBL821335

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 1984
Volume: 27
Issue: 11
First Page: 1416
Last Page: 1421
DOI: 10.1021/jm00377a007

Target ChEMBL ID: CHEMBL613493
ChEMBL Target Name: Vaccinia virus
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
MIC50	=	21	ug.mL-1
MIC50	=	1.9	ug.mL-1
MIC50	=	13	ug.mL-1
MIC50	=	97	ug.mL-1
MIC50	=	3.3	ug.mL-1
MIC50	=	2.3	ug.mL-1
MIC50	=	57	ug.mL-1
MIC50	=	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：Bacillus anthracis

External ID: CHEMBL1690567

Protocol: N/A

Comment: Journal: Antimicrob Agents Chemother
Year: 2010
Volume: 54
Issue: 12
First Page: 5329
Last Page: 5336
DOI: 10.1128/aac.01029-10

Target ChEMBL ID: CHEMBL613904
ChEMBL Target Name: Bacillus anthracis
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment	Data Validity Comment
	IC50				Not Active
50	IC50	=	50000	nM
20	IC50	=	20000	nM
	IC50				Not Active
	IC50				Not Active
190	IC50	=	190000	nM		Outside typical range
	IC50				Not Active
	IC50				Not Active
	IC50				Not Active
	IC50				Not Active
1550	IC50	=	1550000	nM		Outside typical range
	IC50				Not Active
320	IC50	=	320000	nM		Outside typical range
890	IC50	=	890000	nM		Outside typical range
	IC50				Not Active
700	IC50	=	700000	nM		Outside typical range
7190	IC50	=	7190000	nM		Outside typical range
350	IC50	=	350000	nM		Outside typical range
	IC50				Not Active
360	IC50	=	360000	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：Bacillus anthracis

External ID: CHEMBL1690568

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: Antimicrob Agents Chemother
Year: 2010
Volume: 54
Issue: 12
First Page: 5329
Last Page: 5336
DOI: 10.1128/aac.01029-10

Target ChEMBL ID: CHEMBL613904
ChEMBL Target Name: Bacillus anthracis
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Activity Comment	Data Validity Comment
2	IC50	=	2000	nM
1040	IC50	=	1040000	nM		Outside typical range
20	IC50	=	20000	nM
	IC50				Not Active
	IC50				Not Active
	IC50				Not Active
400	IC50	=	400000	nM		Outside typical range
	IC50				Not Active
	IC50				Not Active
200	IC50	=	200000	nM		Outside typical range
	IC50				Not Active
	IC50				Not Active
	IC50				Not Active
190	IC50	=	190000	nM		Outside typical range
	IC50				Not Active
	IC50				Not Active
	IC50				Not Active
	IC50				Not Active
40	IC50	=	40000	nM
	IC50				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：Vaccinia virus

External ID: CHEMBL821892

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 1984
Volume: 27
Issue: 11
First Page: 1416
Last Page: 1421
DOI: 10.1021/jm00377a007

Target ChEMBL ID: CHEMBL613493
ChEMBL Target Name: Vaccinia virus
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
Virus rating	=	1.8
Virus rating	=	2.8
Virus rating	=	0.8
Virus rating	=	2.9
Virus rating	=	1.8
Virus rating	=	3.8
Virus rating	=	0.9
Virus rating	=	1.5
Virus rating	=	1.7

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: CHEMBL637833

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 2000
Volume: 43
Issue: 15
First Page: 2922
Last Page: 2928
DOI: 10.1021/jm0000822

Standard Type	Standard Relation	Standard Value
LogP	=	3.03
LogP	=	4.72
LogP	=	4.69
LogP	=	0.54
LogP	=	2.01
LogP	=	1.85
LogP	=	2.57
LogP	=	0.11
LogP	=	-0.21
LogP	=	1.36
LogP	=	1.58
LogP	=	3.51
LogP	=	2.74
LogP	=	1.38
LogP	=	4.95
LogP	=	0.23
LogP	=	2.78
LogP	=	0.31
LogP	=	1.47
LogP	=	1.43

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

来源：ChEMBL 靶标：J774.A1

External ID: CHEMBL1690571

Protocol: N/A

Comment: Journal: Antimicrob. Agents Chemother.
Year: 2010
Volume: 54
Issue: 12
First Page: 5329
Last Page: 5336
DOI: 10.1128/aac.01029-10

Target ChEMBL ID: CHEMBL614040
ChEMBL Target Name: J774.A1
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	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
Activity	Non-toxic
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：Bacillus anthracis

External ID: CHEMBL925840

Protocol: N/A

Comment: Journal: J. Biol. Chem.
Year: 2007
Volume: 282
Issue: 16
First Page: 12112
Last Page: 12118
DOI: 10.1074/jbc.m611432200

Target ChEMBL ID: CHEMBL613904
ChEMBL Target Name: Bacillus anthracis
ChEMBL Target Type: ORGANISM - Target is a complete organism
Relationship Type: N - Non-molecular target assigned
Confidence: Target assigned is non-molecular

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units	Data Validity Comment
68	Ki	=	68000	nM
777	Ki	=	777000	nM	Outside typical range
34	Ki	=	34000	nM

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

来源：ChEMBL 靶标：Vero

External ID: CHEMBL818437

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 1982
Volume: 25
Issue: 11
First Page: 1334
Last Page: 1338
DOI: 10.1021/jm00353a012

Target ChEMBL ID: CHEMBL391
ChEMBL Target Name: Vero
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
Virus rating	=	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: CHEMBL635931

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 2000
Volume: 43
Issue: 15
First Page: 2922
Last Page: 2928
DOI: 10.1021/jm0000822

Standard Type	Standard Relation	Standard Value
LogP	=	2.79
LogP	=	5.07
LogP	=	5.2
LogP	=	0.5
LogP	=	2.19
LogP	=	2.03
LogP	=	2.18
LogP	=	0.51
LogP	=	-0.07
LogP	=	1.28
LogP	=	1.58
LogP	=	3.37
LogP	=	2.51
LogP	=	1.65
LogP	=	4.77
LogP	=	0.38
LogP	=	2.72
LogP	=	0.29
LogP	=	1.46
LogP	=	1.14

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

来源：ChEMBL 靶标：Adenosine kinase

External ID: CHEMBL4394894

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 Med Chem
Year: 2019
Volume: 62
Issue: 9
First Page: 4483
Last Page: 4499
DOI: 10.1021/acs.jmedchem.9b00020

Target ChEMBL ID: CHEMBL4523271
ChEMBL Target Name: Adenosine kinase
ChEMBL Target Type: SINGLE PROTEIN - Target is a single protein chain
Relationship Type: D - Direct protein target assigned
Confidence: Direct single protein target assigned

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units
2.3	IC50	=	2300	nM
0.1202	Ki	=	120.2	nM
0.1965	IC50	=	196.5	nM
0.0255	Ki	=	25.5	nM

342-69-8 靶点实验数据