Compile Data Set for Download or QSAR
Found 2 Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 1' and Ligand = 'BDBM92127'
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92127(erk000563)
Show SMILES Cc1ccc(Nc2ncc(C)c(n2)-c2c[nH]c(c2)C(=O)N[C@H](CO)c2ccccc2)cc1Br
Show InChI InChI=1S/C25H24BrN5O2/c1-15-8-9-19(11-20(15)26)29-25-28-12-16(2)23(31-25)18-10-21(27-13-18)24(33)30-22(14-32)17-6-4-3-5-7-17/h3-13,22,27,32H,14H2,1-2H3,(H,30,33)(H,28,29,31)/t22-/m1/s1
Affinity DataKi:  3nMAssay Description:Photometric_Method2More data for this Ligand-Target Pair
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92127(erk000563)
Show SMILES Cc1ccc(Nc2ncc(C)c(n2)-c2c[nH]c(c2)C(=O)N[C@H](CO)c2ccccc2)cc1Br
Show InChI InChI=1S/C25H24BrN5O2/c1-15-8-9-19(11-20(15)26)29-25-28-12-16(2)23(31-25)18-10-21(27-13-18)24(33)30-22(14-32)17-6-4-3-5-7-17/h3-13,22,27,32H,14H2,1-2H3,(H,30,33)(H,28,29,31)/t22-/m1/s1
Affinity DataKi:  3nMAssay Description:Assay 1 ...More data for this Ligand-Target Pair
In DepthDetails PubMed