Compile Data Set for Download or QSAR
Found 2 Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 1' and Ligand = 'BDBM92106'
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92106(erk000538)
Show SMILES Cc1cnc(Nc2cccc(F)c2C)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1
Show InChI InChI=1S/C25H24FN5O2/c1-15-12-28-25(30-20-10-6-9-19(26)16(20)2)31-23(15)18-11-21(27-13-18)24(33)29-22(14-32)17-7-4-3-5-8-17/h3-13,22,27,32H,14H2,1-2H3,(H,29,33)(H,28,30,31)/t22-/m1/s1
Affinity DataKi:  2nMAssay Description:Photometric_Method2More data for this Ligand-Target Pair
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92106(erk000538)
Show SMILES Cc1cnc(Nc2cccc(F)c2C)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1
Show InChI InChI=1S/C25H24FN5O2/c1-15-12-28-25(30-20-10-6-9-19(26)16(20)2)31-23(15)18-11-21(27-13-18)24(33)29-22(14-32)17-7-4-3-5-8-17/h3-13,22,27,32H,14H2,1-2H3,(H,29,33)(H,28,30,31)/t22-/m1/s1
Affinity DataKi:  2nMAssay Description:Assay 1 ...More data for this Ligand-Target Pair
In DepthDetails PubMed