Compile Data Set for Download or QSAR
Found 1 Enz. Inhib. hit(s) with Target = 'CHK1_Kinase' and Ligand = 'BDBM91831'
TargetCHK1_Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM91831(Chk1_105)
Show SMILES COc1cc(NC(=O)CCCCCCC(O)=O)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N
Show InChI InChI=1S/C21H23ClN6O5/c1-33-17-9-15(26-19(29)6-4-2-3-5-7-20(30)31)14(22)8-16(17)27-21(32)28-18-12-24-13(10-23)11-25-18/h8-9,11-12H,2-7H2,1H3,(H,26,29)(H,30,31)(H2,25,27,28,32)
Affinity DataKi:  57.9nMAssay Description:33P-Radiometric_Method1More data for this Ligand-Target Pair
Target InfoPDB
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In DepthDetails PubMed