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SMILES: CNc1ncc2cc(-c3ccc(cc3Cl)-n3ccn(C)c3=O)c(=O)n(CCCN)c2n1

InChI Key: InChIKey=XUTAQMUENAMFHY-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50182297   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Serine/threonine-protein kinase PAK 1


(Homo sapiens (Human))		BDBM50182297
PNG
(CHEMBL3818372)
Show SMILES CNc1ncc2cc(-c3ccc(cc3Cl)-n3ccn(C)c3=O)c(=O)n(CCCN)c2n1
Show InChI InChI=1S/C21H22ClN7O2/c1-24-20-25-12-13-10-16(19(30)29(7-3-6-23)18(13)26-20)15-5-4-14(11-17(15)22)28-9-8-27(2)21(28)31/h4-5,8-12H,3,6-7,23H2,1-2H3,(H,24,25,26)
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Similars
PubMed
 13n/an/an/an/an/an/an/an/a



Shanghai Chempartner Inc.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant N-terminal 6-His-tagged PAK1 kinase domain (249 to 545 residues) expressed in Escherichia coli BL21(DE3) assessed as ...

J Med Chem 59: 5520-41 (2016)


BindingDB Entry DOI: 10.7270/Q23X88KT
More data for this
Ligand-Target Pair