BDBM91904 Chk1_38

SMILES Brc1ccc(N2CCCCC2)c(NC(=O)Nc2cnc(cn2)C#N)c1

InChI Key InChIKey=RVRMISIOBJXDAH-UHFFFAOYSA-N

Data  1 KI  1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 91904   

TargetCHK1_Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM91904(Chk1_38)
Show SMILES Brc1ccc(N2CCCCC2)c(NC(=O)Nc2cnc(cn2)C#N)c1
Show InChI InChI=1S/C17H17BrN6O/c18-12-4-5-15(24-6-2-1-3-7-24)14(8-12)22-17(25)23-16-11-20-13(9-19)10-21-16/h4-5,8,10-11H,1-3,6-7H2,(H2,21,22,23,25)
Affinity DataKi:  11.5nMAssay Description:33P-Radiometric_Method1More data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
In DepthDetails PubMed
TargetSerine/threonine-protein kinase Chk1(Homo sapiens (Human))
CSAR

LigandPNGBDBM91904(Chk1_38)
Show SMILES Brc1ccc(N2CCCCC2)c(NC(=O)Nc2cnc(cn2)C#N)c1
Show InChI InChI=1S/C17H17BrN6O/c18-12-4-5-15(24-6-2-1-3-7-24)14(8-12)22-17(25)23-16-11-20-13(9-19)10-21-16/h4-5,8,10-11H,1-3,6-7H2,(H2,21,22,23,25)
Affinity DataIC50: 12nMAssay Description:Abbott Kinase Enzymatics_CHK1/289 CDC25c - IC50(uM) (IC50)More data for this Ligand-Target Pair
In DepthDetails PubMed