BindingDB logo
myBDB logout

null

SMILES: COc1cc(NC(=O)CN(C)C)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

InChI Key: InChIKey=JFUKWQSIQVDPHI-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 14606   
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))		BDBM14606
PNG
(N-(2-chloro-4-{[(5-cyanopyrazin-2-yl)carbamoyl]ami...)
Show SMILES COc1cc(NC(=O)CN(C)C)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N
Show InChI InChI=1S/C17H18ClN7O3/c1-25(2)9-16(26)22-12-5-14(28-3)13(4-11(12)18)23-17(27)24-15-8-20-10(6-19)7-21-15/h4-5,7-8H,9H2,1-3H3,(H,22,26)(H2,21,23,24,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 3n/an/an/an/a7.422



Abbott Laboratories



Assay Description
Chk1 kinase activity was assayed in reaction buffer containing substrate, enzyme, and inhibitor in the presence of 5uM ATP/[gamma-33P] ATP. 33P incor...

Bioorg Med Chem Lett 16: 2293-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.028
BindingDB Entry DOI: 10.7270/Q26971TD
More data for this
Ligand-Target Pair