Compile Data Set for Download or QSAR
Found 2 Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 1' and Ligand = 'BDBM92199'
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92199(erk000658)
Show SMILES Cc1cnc(Nc2ccc(F)cc2F)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1
Show InChI InChI=1S/C24H21F2N5O2/c1-14-11-28-24(30-19-8-7-17(25)10-18(19)26)31-22(14)16-9-20(27-12-16)23(33)29-21(13-32)15-5-3-2-4-6-15/h2-12,21,27,32H,13H2,1H3,(H,29,33)(H,28,30,31)/t21-/m1/s1
Affinity DataKi:  2nMAssay Description:Photometric_Method2More data for this Ligand-Target Pair
In DepthDetails PubMed
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92199(erk000658)
Show SMILES Cc1cnc(Nc2ccc(F)cc2F)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1
Show InChI InChI=1S/C24H21F2N5O2/c1-14-11-28-24(30-19-8-7-17(25)10-18(19)26)31-22(14)16-9-20(27-12-16)23(33)29-21(13-32)15-5-3-2-4-6-15/h2-12,21,27,32H,13H2,1H3,(H,29,33)(H,28,30,31)/t21-/m1/s1
Affinity DataKi:  2nMAssay Description:Assay 1 ...More data for this Ligand-Target Pair
In DepthDetails PubMed