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

来源：ChEMBL 靶标：Acetylcholinesterase

External ID: CHEMBL3282825

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: 1977
Volume: 20
Issue: 1
First Page: 161
Last Page: 164
DOI: 10.1021/jm00211a035

Target ChEMBL ID: CHEMBL4078
ChEMBL Target Name: Acetylcholinesterase
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	Activity Comment	Data Validity Comment
392	Ki	=	392000	nM		Outside typical range
11300	Ki	=	11300000	nM		Outside typical range
6070	Ki	=	6070000	nM		Outside typical range
496	Ki	=	496000	nM		Outside typical range
10000	Ki	=	10000000	nM		Outside typical range
286	Ki	=	286000	nM		Outside typical range
562	Ki	=	562000	nM		Outside typical range
	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：Acetylcholinesterase

External ID: CHEMBL3282824

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: 1977
Volume: 20
Issue: 1
First Page: 161
Last Page: 164
DOI: 10.1021/jm00211a035

Target ChEMBL ID: CHEMBL4078
ChEMBL Target Name: Acetylcholinesterase
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	Activity Comment	Data Validity Comment
565	Ki	=	565000	nM		Outside typical range
9270	Ki	=	9270000	nM		Outside typical range
3250	Ki	=	3250000	nM		Outside typical range
624	Ki	=	624000	nM		Outside typical range
5.43	Ki	=	5430	nM
939	Ki	=	939000	nM		Outside typical range
1950	Ki	=	1950000	nM		Outside typical range
	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: CHEMBL3282827

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 1977
Volume: 20
Issue: 1
First Page: 161
Last Page: 164
DOI: 10.1021/jm00211a035

Standard Type	Standard Relation	Standard Value
pKa	=	1.31
pKa	=	6.5

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

来源：ChEMBL 靶标：Acetylcholinesterase

External ID: CHEMBL3282826

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: 1977
Volume: 20
Issue: 1
First Page: 161
Last Page: 164
DOI: 10.1021/jm00211a035

Target ChEMBL ID: CHEMBL4078
ChEMBL Target Name: Acetylcholinesterase
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	Activity Comment	Data Validity Comment
333	Ki	=	333000	nM		Outside typical range
5930	Ki	=	5930000	nM		Outside typical range
109000	Ki	=	109000000	nM		Outside typical range
839	Ki	=	839000	nM		Outside typical range
1000	Ki	=	1000000	nM		Outside typical range
2.95	Ki	=	2950	nM
51100	Ki	=	51100000	nM		Outside typical range
	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: CHEMBL4181387

Protocol: N/A

Comment: Journal: Bioorg Med Chem Lett
Year: 2017
Volume: 27
Issue: 23
First Page: 5100
Last Page: 5108
DOI: 10.1016/j.bmcl.2017.09.041

Standard Type	Standard Relation	Standard Value
pKa	=	2.3
pKa	=	1.3
pKa	=	0.7

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: CHEMBL4181385

Protocol: N/A

Comment: Journal: Bioorg Med Chem Lett
Year: 2017
Volume: 27
Issue: 23
First Page: 5100
Last Page: 5108
DOI: 10.1016/j.bmcl.2017.09.041

Standard Type	Standard Relation	Standard Value
LogP	=	2.09
LogP	=	1.71
LogP	=	-0.72
LogP	=	-0.44
LogP	=	-0.26
LogP	=	4.93
LogP	=	4.07
LogP	=	3.32
LogP	=	3.55
LogP	=	4.57

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

来源：ChEMBL 靶标：Thromboxane-A synthase

External ID: CHEMBL814399

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 1981
Volume: 24
Issue: 10
First Page: 1149
Last Page: 1155
DOI: 10.1021/jm00142a006

Target ChEMBL ID: CHEMBL1835
ChEMBL Target Name: Thromboxane-A synthase
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	=	12	%

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

来源：ChEMBL 靶标：Acetylcholinesterase

External ID: CHEMBL3282823

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 1977
Volume: 20
Issue: 1
First Page: 161
Last Page: 164
DOI: 10.1021/jm00211a035

Target ChEMBL ID: CHEMBL4078
ChEMBL Target Name: Acetylcholinesterase
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	Activity Comment	Data Validity Comment
432	Ki	=	432000	nM		Outside typical range
3010	Ki	=	3010000	nM		Outside typical range
5420	Ki	=	5420000	nM		Outside typical range
188	Ki	=	188000	nM		Outside typical range
11.1	Ki	=	11100	nM
317	Ki	=	317000	nM		Outside typical range
468	Ki	=	468000	nM		Outside typical range
	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: CHEMBL2173908

Protocol: N/A

Comment: Journal: J. Med. Chem.
Year: 2012
Volume: 55
Issue: 13
First Page: 6002
Last Page: 6020
DOI: 10.1021/jm300343m

Standard Type	Standard Relation	Standard Value
pKa	=	-2.97
pKa	=	5.2
pKa	=	7
pKa	=	2.19
pKa	=	2.3
pKa	=	2.52
pKa	=	-3.8
pKa	=	1.3
pKa	=	0.4
pKa	=	11.2
pKa	=	8.4
pKa	=	11.27
pKa	=	9.8
pKa	=	0.8
pKa	=	-5
pKa	=	10.7
pKa	=	10.89
pKa	=	-0.51

289-95-2 靶点实验数据