Compile Data Set for Download or QSAR
Found 2 Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 1' and Ligand = 'BDBM92130'
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92130(erk000566)
Show SMILES Cc1cc(C)cc(Nc2ncc(C)c(n2)-c2c[nH]c(c2)C(=O)N[C@H](CO)c2ccccc2)c1
Show InChI InChI=1S/C26H27N5O2/c1-16-9-17(2)11-21(10-16)29-26-28-13-18(3)24(31-26)20-12-22(27-14-20)25(33)30-23(15-32)19-7-5-4-6-8-19/h4-14,23,27,32H,15H2,1-3H3,(H,30,33)(H,28,29,31)/t23-/m1/s1
Affinity DataKi:  3nMAssay Description:Photometric_Method2More data for this Ligand-Target Pair
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92130(erk000566)
Show SMILES Cc1cc(C)cc(Nc2ncc(C)c(n2)-c2c[nH]c(c2)C(=O)N[C@H](CO)c2ccccc2)c1
Show InChI InChI=1S/C26H27N5O2/c1-16-9-17(2)11-21(10-16)29-26-28-13-18(3)24(31-26)20-12-22(27-14-20)25(33)30-23(15-32)19-7-5-4-6-8-19/h4-14,23,27,32H,15H2,1-3H3,(H,30,33)(H,28,29,31)/t23-/m1/s1
Affinity DataKi:  3nMAssay Description:Assay 1 ...More data for this Ligand-Target Pair
In DepthDetails PubMed