Compile Data Set for Download or QSAR
Found 1 Enz. Inhib. hit(s) with Target = 'CHK1_Kinase' and Ligand = 'BDBM91838'
TargetCHK1_Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM91838(Chk1_111)
Show SMILES COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(NC(=O)CCS(=O)(=O)c4ccccc4)cc3NC2=O)c1
Show InChI InChI=1S/C29H24N4O7S/c1-40-27-16-19(8-12-26(27)33(36)37)18-7-10-22-24(15-18)31-23-11-9-20(17-25(23)32-29(22)35)30-28(34)13-14-41(38,39)21-5-3-2-4-6-21/h2-12,15-17,31H,13-14H2,1H3,(H,30,34)(H,32,35)
Affinity DataKi:  7.17nMAssay Description:33P-Radiometric_Method1More data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed