Compile Data Set for Download or QSAR
Found 2 Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 1' and Ligand = 'BDBM92097'
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92097(erk000527)
Show SMILES Cc1cnc(Nc2cccc(O)c2C)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1
Show InChI InChI=1S/C25H25N5O3/c1-15-12-27-25(29-19-9-6-10-22(32)16(19)2)30-23(15)18-11-20(26-13-18)24(33)28-21(14-31)17-7-4-3-5-8-17/h3-13,21,26,31-32H,14H2,1-2H3,(H,28,33)(H,27,29,30)/t21-/m1/s1
Affinity DataKi:  3nMAssay Description:Photometric_Method2More data for this Ligand-Target Pair
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92097(erk000527)
Show SMILES Cc1cnc(Nc2cccc(O)c2C)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1
Show InChI InChI=1S/C25H25N5O3/c1-15-12-27-25(29-19-9-6-10-22(32)16(19)2)30-23(15)18-11-20(26-13-18)24(33)28-21(14-31)17-7-4-3-5-8-17/h3-13,21,26,31-32H,14H2,1-2H3,(H,28,33)(H,27,29,30)/t21-/m1/s1
Affinity DataKi:  3nMAssay Description:Assay 1 ...More data for this Ligand-Target Pair
In DepthDetails PubMed