Compound Detail

CHEMBL430503

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CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc2cc(Cl)ccc2[nH]1

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL430503
Phase	Preclinical
Structure Type	MOL
InChI Key	SWJYEZLPKNELRP-SFHVURJKSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

369.9

MW (Da)

3.25

ALogP

HBA

HBD

65.2

PSA (Å²)

0.72

QED

Ro5 Violations

Rot. Bonds

First in Class Prodrug

IC50 4 meas. best 7.29

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Glycogen phosphorylase, liver form CHEMBL2568	IC50	7.29	7.19	51.0	2
Unchecked CHEMBL612545	IC50	5.72	5.72	1900.0	1
Hepatocyte CHEMBL613362	IC50	5.58	5.58	2600.0	1

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Glycogen phosphorylase, liver form	IC50	=	51.0	nM	7.29	Inhibition of recombinant human liver GPa by multienzyme coupled assay	16945526
Glycogen phosphorylase, liver form	IC50	=	82.0	nM	7.09	In vitro inhibitory activity against recombinant human liver glycogen phosphoryl...	9685232
Unchecked	IC50	=	1900.0	nM	5.72	Inhibition of forskolin-stimulated glycogenolysis in SK-HEP-1 cells	9685232
Hepatocyte	IC50	=	2600.0	nM	5.58	Inhibition of glucose output in glucagon challenged rat hepatocytes	16945526

PubMed	DOI	Target Context	# Activities
9685232	10.1021/jm980264k	Glycogen phosphorylase, liver form	1
9685232	10.1021/jm980264k	Unchecked	1
16945526	10.1016/j.bmcl.2006.08.047	Glycogen phosphorylase, liver form	1
16945526	10.1016/j.bmcl.2006.08.047	Hepatocyte	1
-	10.6019/CHEMBL3301361	No relevant target	1

Data from ChEMBL 36 via Core Engine