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: CHEMBL2161109

Protocol: N/A

Comment: Journal: ACS Med. Chem. Lett.
Year: 2012
Volume: 3
Issue: 10
First Page: 828
Last Page: 833
DOI: 10.1021/ml300192k

Standard Type	Standard Relation	Standard Value
FC	=	3.6
FC	=	24.1
FC	=	9.8
FC	=	13.4
FC	=	0.6
FC	=	2.3
FC	=	4.9

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

来源：ChEMBL 靶标：Nuclear receptor ROR-gamma

External ID: CHEMBL4714686

Protocol: N/A

Comment: Journal: ACS Med Chem Lett
Year: 2021
Volume: 12
Issue: 4.0
First Page: 631
Last Page: 639
DOI: 10.1021/acsmedchemlett.1c00029

Target ChEMBL ID: CHEMBL1741186
ChEMBL Target Name: Nuclear receptor ROR-gamma
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
Delta Tm	=	-2.4	degrees C
Delta Tm	=	-2.3	degrees C
Delta Tm	=	-1.5	degrees C
Delta Tm	=	-0.2	degrees C
Delta Tm	=	10.4	degrees C
Delta Tm	=	3.5	degrees C

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

来源：ChEMBL 靶标：Smoothened homolog

External ID: CHEMBL4831066

Protocol: N/A

Comment: Journal: J Med Chem
Year: 2021
Volume: 64
Issue: 18.0
First Page: 13830
Last Page: 13840
DOI: 10.1021/acs.jmedchem.1c01220

Target ChEMBL ID: CHEMBL6080
ChEMBL Target Name: Smoothened homolog
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

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: CHEMBL2161110

Protocol: N/A

Comment: Journal: ACS Med. Chem. Lett.
Year: 2012
Volume: 3
Issue: 10
First Page: 828
Last Page: 833
DOI: 10.1021/ml300192k

Standard Type	Standard Relation	Standard Value
Selectivity ratio	=	9
Selectivity ratio	=	7.1
Selectivity ratio	=	6.8
Selectivity ratio	=	2.6
Selectivity ratio	=	22.8
Selectivity ratio	=	17.8

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

来源：ChEMBL 靶标：Nuclear receptor ROR-gamma

External ID: CHEMBL4714687

Protocol: N/A

Comment: Journal: ACS Med Chem Lett
Year: 2021
Volume: 12
Issue: 4.0
First Page: 631
Last Page: 639
DOI: 10.1021/acsmedchemlett.1c00029

Target ChEMBL ID: CHEMBL1741186
ChEMBL Target Name: Nuclear receptor ROR-gamma
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
Delta Tm	=	-1.8	degrees C
Delta Tm	=	-2.5	degrees C
Delta Tm	=	-1.5	degrees C
Delta Tm	=	-0.2	degrees C
Delta Tm	=	9.9	degrees C
Delta Tm	=	3.2	degrees C

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: CHEMBL2161108

Protocol: N/A

Comment: Journal: ACS Med. Chem. Lett.
Year: 2012
Volume: 3
Issue: 10
First Page: 828
Last Page: 833
DOI: 10.1021/ml300192k

Standard Type	Standard Relation	Standard Value
FC	=	32.4
FC	=	4.7
FC	=	69.9
FC	=	91.8
FC	=	1.6
FC	=	52.5
FC	=	87.1

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

来源：ChEMBL 靶标：Nuclear receptor ROR-gamma

External ID: CHEMBL4714685

Protocol: N/A

Comment: Journal: ACS Med Chem Lett
Year: 2021
Volume: 12
Issue: 4.0
First Page: 631
Last Page: 639
DOI: 10.1021/acsmedchemlett.1c00029

Target ChEMBL ID: CHEMBL1741186
ChEMBL Target Name: Nuclear receptor ROR-gamma
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
Delta Tm	=	-0.6	degrees C
Delta Tm	=	3	degrees C
Delta Tm	=	5.8	degrees C
Delta Tm	=	2.5	degrees C
Delta Tm	=	7.5	degrees C
Delta Tm	=	2.1	degrees C

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

来源：ChEMBL 靶标：Nuclear receptor ROR-gamma

External ID: CHEMBL4714688

Protocol: N/A

Comment: Journal: ACS Med Chem Lett
Year: 2021
Volume: 12
Issue: 4.0
First Page: 631
Last Page: 639
DOI: 10.1021/acsmedchemlett.1c00029

Target ChEMBL ID: CHEMBL1741186
ChEMBL Target Name: Nuclear receptor ROR-gamma
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
Delta Tm	=	-1.7	degrees C
Delta Tm	=	-2.7	degrees C
Delta Tm	=	-1.9	degrees C
Delta Tm	=	-0.1	degrees C
Delta Tm	=	9	degrees C
Delta Tm	=	2.3	degrees C

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

来源：ChEMBL 靶标：Smoothened homolog

External ID: CHEMBL4831068

Protocol: N/A

Comment: Journal: J Med Chem
Year: 2021
Volume: 64
Issue: 18.0
First Page: 13830
Last Page: 13840
DOI: 10.1021/acs.jmedchem.1c01220

Target ChEMBL ID: CHEMBL6080
ChEMBL Target Name: Smoothened homolog
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
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：Smoothened homolog

External ID: CHEMBL4831067

Protocol: N/A

Comment: Journal: J Med Chem
Year: 2021
Volume: 64
Issue: 18.0
First Page: 13830
Last Page: 13840
DOI: 10.1021/acs.jmedchem.1c01220

Target ChEMBL ID: CHEMBL6080
ChEMBL Target Name: Smoothened homolog
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
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：Nuclear receptor ROR-gamma

External ID: CHEMBL4714679

Protocol: N/A

Comment: Journal: ACS Med Chem Lett
Year: 2021
Volume: 12
Issue: 4.0
First Page: 631
Last Page: 639
DOI: 10.1021/acsmedchemlett.1c00029

Target ChEMBL ID: CHEMBL1741186
ChEMBL Target Name: Nuclear receptor ROR-gamma
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	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：Nuclear receptor ROR-gamma

External ID: CHEMBL4714683

Protocol: N/A

Comment: Journal: ACS Med Chem Lett
Year: 2021
Volume: 12
Issue: 4.0
First Page: 631
Last Page: 639
DOI: 10.1021/acsmedchemlett.1c00029

Target ChEMBL ID: CHEMBL1741186
ChEMBL Target Name: Nuclear receptor ROR-gamma
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	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：N/A

External ID: CHEMBL1246370

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: 18
First Page: 6613
Last Page: 6624
DOI: 10.1016/j.bmc.2010.07.038

PubChem Standard Value	Standard Type	Standard Relation	Standard Value	Standard Units
3	EC50	=	3000	nM
1	EC50	=	1000	nM
0.2	EC50	=	200	nM

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

来源：ChEMBL 靶标：Nuclear receptor ROR-gamma

External ID: CHEMBL4714681

Protocol: N/A

Comment: Journal: ACS Med Chem Lett
Year: 2021
Volume: 12
Issue: 4.0
First Page: 631
Last Page: 639
DOI: 10.1021/acsmedchemlett.1c00029

Target ChEMBL ID: CHEMBL1741186
ChEMBL Target Name: Nuclear receptor ROR-gamma
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	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：NPC1-like intracellular cholesterol transporter 1

External ID: CHEMBL3362444

Protocol: N/A

Comment: Journal: Bioorg. Med. Chem. Lett.
Year: 2014
Volume: 24
Issue: 15
First Page: 3480
Last Page: 3485
DOI: 10.1016/j.bmcl.2014.05.064

Target ChEMBL ID: CHEMBL2027
ChEMBL Target Name: Niemann-Pick C1-like protein 1
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	Not Active
Activity	Not Active
Activity	Not Active
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：Oxysterols receptor LXR-alpha

External ID: CHEMBL712591

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 2001
Volume: 44
Issue: 6
First Page: 886
Last Page: 897
DOI: 10.1021/jm0004749

Target ChEMBL ID: CHEMBL2808
ChEMBL Target Name: LXR-alpha
ChEMBL Target Type: SINGLE PROTEIN - Target is a single protein chain
Relationship Type: H - Homologous protein target assigned
Confidence: Homologous single protein target assigned

Standard Type	Standard Relation	Standard Value
RE	<	0.1
RE	=	0.2
RE	=	1.1
RE	=	0.7
RE	=	0.85
RE	=	1
RE	=	1.4
RE	=	1
RE	=	0.35
RE	=	0.85
RE	=	1
RE	=	0.3
RE	=	1
RE	<	0.1

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

来源：ChEMBL 靶标：Nuclear receptor ROR-gamma

External ID: CHEMBL4714675

Protocol: N/A

Comment: Journal: ACS Med Chem Lett
Year: 2021
Volume: 12
Issue: 4.0
First Page: 631
Last Page: 639
DOI: 10.1021/acsmedchemlett.1c00029

Target ChEMBL ID: CHEMBL1741186
ChEMBL Target Name: Nuclear receptor ROR-gamma
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	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：N/A

External ID: CHEMBL2423071

Protocol: N/A

Comment: Journal: Bioorg. Med. Chem.
Year: 2013
Volume: 21
Issue: 17
First Page: 5297
Last Page: 5309
DOI: 10.1016/j.bmc.2013.06.022

Standard Type	Activity Comment
Activity	Not Active
Activity	Not Active
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：Oxysterol-binding protein 1

External ID: CHEMBL5320826

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: 2023
Volume: 66
Issue: 6
First Page: 3866
Last Page: 3875
DOI: 10.1021/acs.jmedchem.2c01025

Target ChEMBL ID: CHEMBL4523203
ChEMBL Target Name: Oxysterol-binding protein 1
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
0.12	Ki	=	120	nM
0.068	Ki	=	68	nM
0.13	Ki	=	130	nM
100	Ki	>	100000	nM
50	Ki	>	50000	nM
30	Ki	>	30000	nM
10	Ki	>	10000	nM
100	Ki	>	100000	nM
0.078	Ki	=	78	nM
10	Ki	>	10000	nM
0.12	Ki	=	120	nM
20	Ki	>	20000	nM
50	Ki	>	50000	nM
100	Ki	>	100000	nM

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

来源：ChEMBL 靶标：Oxysterol-binding protein 2

External ID: CHEMBL5320827

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: 2023
Volume: 66
Issue: 6
First Page: 3866
Last Page: 3875
DOI: 10.1021/acs.jmedchem.2c01025

Target ChEMBL ID: CHEMBL5465343
ChEMBL Target Name: Oxysterol-binding protein 2
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	Ki	=	320	nM
50	Ki	>	50000	nM
30	Ki	>	30000	nM
15	Ki	>	15000	nM
3	Ki	>	3000	nM
0.092	Ki	=	92	nM
20	Ki	>	20000	nM
0.87	Ki	>	870	nM
30	Ki	>	30000	nM
50	Ki	>	50000	nM
100	Ki	>	100000	nM

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

来源：ChEMBL 靶标：Smoothened homolog

External ID: CHEMBL4831073

Protocol: N/A

Comment: Journal: J Med Chem
Year: 2021
Volume: 64
Issue: 18.0
First Page: 13830
Last Page: 13840
DOI: 10.1021/acs.jmedchem.1c01220

Target ChEMBL ID: CHEMBL6080
ChEMBL Target Name: Smoothened homolog
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

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

来源：ChEMBL 靶标：Smoothened homolog

External ID: CHEMBL4831072

Protocol: N/A

Comment: Journal: J Med Chem
Year: 2021
Volume: 64
Issue: 18.0
First Page: 13830
Last Page: 13840
DOI: 10.1021/acs.jmedchem.1c01220

Target ChEMBL ID: CHEMBL6080
ChEMBL Target Name: Smoothened homolog
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

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

来源：ChEMBL 靶标：Smoothened homolog

External ID: CHEMBL4831071

Protocol: N/A

Comment: Journal: J Med Chem
Year: 2021
Volume: 64
Issue: 18.0
First Page: 13830
Last Page: 13840
DOI: 10.1021/acs.jmedchem.1c01220

Target ChEMBL ID: CHEMBL6080
ChEMBL Target Name: Smoothened homolog
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	Not Active

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

来源：BindingDB 靶标：N/A

External ID: BindingDB_2414_1

Protocol: N/A

Comment: Compounds with any of Ki, IC50, Kd, or EC50 activity value <= 10uM are labeled as "Active".
If multiple measurements are available for a given compound, it is labeled as "Active" if any of the measurements meet the criterion. Activity values are checked in the order of Ki, IC50, Kd, and EC50. The first entry that meets the above activity threshold is used to determine "Standard Type", "Standard Relation", and "PubChem Standard Value". Otherwise, the first non-empty entry will be used to set those values.

Standard Type	PubChem Standard Value	EC50	Target Accession(s)	Ligand	Target
EC50	0.47	470	Q13133	BDBM20175	Oxysterols receptor LXR-alpha
EC50	0.325	325	Q13133	BDBM20177	Oxysterols receptor LXR-alpha
EC50	5.9	5900	Q13133	BDBM20178	Oxysterols receptor LXR-alpha
EC50	0.13	130	Q13133	BDBM20180	Oxysterols receptor LXR-alpha
EC50	0.22	220	Q13133	BDBM20181	Oxysterols receptor LXR-alpha
EC50	1.16	1160	Q13133	BDBM20182	Oxysterols receptor LXR-alpha
EC50	0.25	250	Q13133	BDBM20183	Oxysterols receptor LXR-alpha
EC50	0.18	180	Q13133	BDBM20185	Oxysterols receptor LXR-alpha
EC50	0.17	170	Q13133	BDBM20186	Oxysterols receptor LXR-alpha
EC50	3	3000	Q13133	BDBM20190	Oxysterols receptor LXR-alpha

516-72-3 靶点实验数据