Compile Data Set for Download or QSAR
Found 1 Enz. Inhib. hit(s) with Target = 'CHK1_Kinase' and Ligand = 'BDBM91842'
TargetCHK1_Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM91842(Chk1_117)
Show SMILES COC(=O)Cc1ccc2Nc3cc(c(C)cc3C(=O)Nc2c1)-c1ccc(c(OC)c1)[N+]([O-])=O
Show InChI InChI=1S/C24H21N3O6/c1-13-8-17-19(12-16(13)15-5-7-21(27(30)31)22(11-15)32-2)25-18-6-4-14(10-23(28)33-3)9-20(18)26-24(17)29/h4-9,11-12,25H,10H2,1-3H3,(H,26,29)
Affinity DataKi:  49.4nMAssay Description:33P-Radiometric_Method1More data for this Ligand-Target Pair
Target InfoPDB
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