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: CHEMBL4314380

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	=	3.4
Ratio IC50	=	0.94

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

来源：ChEMBL 靶标：Fructose-1,6-bisphosphatase 1

External ID: CHEMBL4729761

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: 2020
Volume: 28
Issue: 18
First Page: 115624
Last Page: 115624
DOI: 10.1016/j.bmc.2020.115624

Target ChEMBL ID: CHEMBL3975
ChEMBL Target Name: Fructose-1,6-bisphosphatase
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
3.3	IC50	=	3300	nM
4.9	IC50	=	4900	nM
0.72	IC50	=	720	nM
16	IC50	=	16000	nM
1.6	IC50	=	1600	nM
0.24	IC50	=	240	nM
0.4	IC50	=	400	nM
0.32	IC50	=	320	nM
16	IC50	=	16000	nM
30	IC50	=	30000	nM
0.23	IC50	=	230	nM
0.54	IC50	=	540	nM
0.89	IC50	=	890	nM
0.49	IC50	=	490	nM
0.15	IC50	=	150	nM
0.16	IC50	=	160	nM
0.38	IC50	=	380	nM
0.23	IC50	=	230	nM
0.38	IC50	=	380	nM
0.37	IC50	=	370	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: CHEMBL4314379

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	=	1.9
Ratio IC50	=	0.97

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: CHEMBL4314378

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	=	3.8
Ratio IC50	=	1.4

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: CHEMBL3868062

Protocol: N/A

Comment: Journal: Bioorg Med Chem
Year: 2016
Volume: 24
Issue: 24
First Page: 6315
Last Page: 6319
DOI: 10.1016/j.bmc.2016.09.053

Standard Type	Standard Text Value	Standard Units
Stability	Unstable	%

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

来源：ChEMBL 靶标：Fructose-1,6-bisphosphatase 1

External ID: CHEMBL4314376

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: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Target ChEMBL ID: CHEMBL3975
ChEMBL Target Name: Fructose-1,6-bisphosphatase
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
0.32	IC50	=	320	nM
0.79	IC50	=	790	nM
1.8	IC50	=	1800	nM
3.1	IC50	=	3100	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: CHEMBL4314374

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	>	625
Ratio IC50	>	556

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

来源：ChEMBL 靶标：Fructose-1,6-bisphosphatase 1

External ID: CHEMBL4314406

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Target ChEMBL ID: CHEMBL3975
ChEMBL Target Name: Fructose-1,6-bisphosphatase
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 Units	Activity Comment
Inhibition	%	Active
Inhibition	%	Active

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

来源：ChEMBL 靶标：Fructose-1,6-bisphosphatase 1

External ID: CHEMBL4314405

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Target ChEMBL ID: CHEMBL3975
ChEMBL Target Name: Fructose-1,6-bisphosphatase
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	=	100	%
Inhibition	=	100	%

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: CHEMBL4314388

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	=	26
Ratio IC50	=	10

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: CHEMBL4314387

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	=	6.9
Ratio IC50	=	1.9

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: CHEMBL4314386

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	=	13
Ratio IC50	=	5.7

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: CHEMBL4314385

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	=	37.8
Ratio IC50	=	3.8

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: CHEMBL4314384

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	=	7.2
Ratio IC50	=	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: CHEMBL4314383

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	=	2.8
Ratio IC50	=	1.2

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: CHEMBL4314382

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	=	2.8
Ratio IC50	=	1.2

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: CHEMBL4314381

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	>	1010
Ratio IC50	>	1000

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: CHEMBL4314424

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Activity Comment
Ratio IC50	Not Determined
Ratio IC50	Not Determined

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

来源：ChEMBL 靶标：Fructose-1,6-bisphosphatase 1

External ID: CHEMBL4314423

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Target ChEMBL ID: CHEMBL3975
ChEMBL Target Name: Fructose-1,6-bisphosphatase
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	Activity Comment
Activity	Active
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: CHEMBL4314389

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Standard Relation	Standard Value
Ratio IC50	=	19
Ratio IC50	=	4.2

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

来源：ChEMBL 靶标：Fructose-1,6-bisphosphatase 1

External ID: CHEMBL4314404

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Target ChEMBL ID: CHEMBL3975
ChEMBL Target Name: Fructose-1,6-bisphosphatase
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 Units	Activity Comment
Inhibition	%	Active
Inhibition	%	Active

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

来源：Center for Chemical Genomics, University of Michigan 靶标：

External ID: MScreen:TargetID_600

Protocol: C-terminally 6xHis tagged CDK2/Cyclin A complex and N-terminally Flag tagged CDC25B C473S (372-566) were expressed and purified. Proteins were incubated together at a final concentration of 125 nM each for 1 hr prior to incubation with compound for 1 hr, followed by addition of anti-6xHis europium cryptate donor beads (Cisbio) and anti-Flag XL-665 acceptor beads (Cisbio) at a final dilution of 1:350 for 1 hr. 20mM potassium fluoride was added 10 minute prior to plate reading. Assay reagents were dispensed using a multidrop liquid dispenser (Thermo Scientific) onto uncoated, black, low-volume, 384-well plates (Corning). Assay plates were quantified using an Envision plate reader (Perkin-Elmer) with excitation of the europium crytate donor at 337 nm wavelength and emission of the donor at 620 nm and emission of the XL-665 acceptor at 665 nm in 18 uL volumes. Assays were performed in a buffer containing 50 mM Tris (pH 7.5), 50 mM NaCl, 10mM MgCl2, 1mM TCEP, with addition of and 1mM ATP, 0.05% BSA, and 0.05% Tween-20 immediately prior to the start of the assay.

Comment: The activity outcome is based on a Z-score (number of standard deviations from the negative control mean) of 3 or higher on at least 50% times that the sample was screened.
For instance, if the sample was screened in n=4 runs, it would be considered active only if it had a Z-score of 3 or above in at least 2 runs.

This screen was funded by NIH grant number: R01CA181185

Z_SCORE
0.28
-0.54
-0.02
0.22
0.37
-0.81
-0.26
-0.14
-0.61
-0.44
0.29
0.22
-0.12
-0.13
0.95
-0.29
-0.37
0.17
-0.64
-0.78

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: CHEMBL4314397

Protocol: N/A

Comment: Journal: Eur J Med Chem
Year: 2019
Volume: 184
First Page: 111749
Last Page: 111749
DOI: 10.1016/j.ejmech.2019.111749

Standard Type	Activity Comment
IC50	Not Determined
IC50	Not Determined

705-84-0 靶点实验数据