Compile Data Set for Download or QSAR
Found 2 Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 1' and Ligand = 'BDBM92050'
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
CSAR

LigandPNGBDBM92050(erk000465)
Show SMILES Cc1cnc(N[C@H]2CCCC[C@H]2O)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1
Show InChI InChI=1S/C24H29N5O3/c1-15-12-26-24(28-18-9-5-6-10-21(18)31)29-22(15)17-11-19(25-13-17)23(32)27-20(14-30)16-7-3-2-4-8-16/h2-4,7-8,11-13,18,20-21,25,30-31H,5-6,9-10,14H2,1H3,(H,27,32)(H,26,28,29)/t18-,20+,21+/m0/s1
Affinity DataKi:  7nMAssay Description:Assay 1 ...More data for this Ligand-Target Pair
In DepthDetails PubMed
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
CSAR

LigandPNGBDBM92050(erk000465)
Show SMILES Cc1cnc(N[C@H]2CCCC[C@H]2O)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1
Show InChI InChI=1S/C24H29N5O3/c1-15-12-26-24(28-18-9-5-6-10-21(18)31)29-22(15)17-11-19(25-13-17)23(32)27-20(14-30)16-7-3-2-4-8-16/h2-4,7-8,11-13,18,20-21,25,30-31H,5-6,9-10,14H2,1H3,(H,27,32)(H,26,28,29)/t18-,20+,21+/m0/s1
Affinity DataKi:  7.10nMAssay Description:Photometric_Method2More data for this Ligand-Target Pair
In DepthDetails PubMed