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BDBM50097123 CHEMBL3580952

SMILES: CCCc1cc(Nc2nc(nc3ccsc23)N2CCC(N)CC2)n[nH]1

InChI Key: InChIKey=HLDNRRBRAORSQF-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50097123   
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
PAK 1/CDC42


(Homo sapiens (Human))		BDBM50097123
PNG
(CHEMBL3580952)
Show SMILES CCCc1cc(Nc2nc(nc3ccsc23)N2CCC(N)CC2)n[nH]1
Show InChI InChI=1S/C17H23N7S/c1-2-3-12-10-14(23-22-12)20-16-15-13(6-9-25-15)19-17(21-16)24-7-4-11(18)5-8-24/h6,9-11H,2-5,7-8,18H2,1H3,(H2,19,20,21,22,23)
PDB

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UniProtKB/TrEMBL

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Similars
Article
PubMed
 48n/an/an/an/an/an/an/an/a



Shanghai Chempartner Inc.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PAK1 kinase domain using coumarin/fluorescein-labeled FRET peptide as substrate assessed as substrate phosphorylation...

J Med Chem 58: 5121-36 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00572
BindingDB Entry DOI: 10.7270/Q2DV1MN9
More data for this
Ligand-Target Pair