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BDBM50414082 CHEMBL550209

SMILES: Clc1ccc(N2CCCC2)c(NC(=O)Nc2cnc(cn2)C#N)c1

InChI Key: InChIKey=OBMVEORXOLGZKX-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50414082   
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 Chk1


(Homo sapiens (Human))
BDBM50414082
PNG
(CHEMBL550209)
Show SMILES Clc1ccc(N2CCCC2)c(NC(=O)Nc2cnc(cn2)C#N)c1
Show InChI InChI=1S/C16H15ClN6O/c17-11-3-4-14(23-5-1-2-6-23)13(7-11)21-16(24)22-15-10-19-12(8-18)9-20-15/h3-4,7,9-10H,1-2,5-6H2,(H2,20,21,22,24)
PDB
MMDB

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
3.20n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Chk1


J Med Chem 52: 3159-65 (2009)


Article DOI: 10.1021/jm801444x
BindingDB Entry DOI: 10.7270/Q2FF3TM8
More data for this
Ligand-Target Pair