Compile Data Set for Download or QSAR
Found 2 Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 1' and Ligand = 'BDBM92045'
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92045(erk000460)
Show SMILES Cc1cnc(NC2(CO)CC2)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1
Show InChI InChI=1S/C22H25N5O3/c1-14-10-24-21(27-22(13-29)7-8-22)26-19(14)16-9-17(23-11-16)20(30)25-18(12-28)15-5-3-2-4-6-15/h2-6,9-11,18,23,28-29H,7-8,12-13H2,1H3,(H,25,30)(H,24,26,27)/t18-/m1/s1
Affinity DataKi:  1nMAssay Description:Photometric_Method2More data for this Ligand-Target Pair
In DepthDetails PubMed
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92045(erk000460)
Show SMILES Cc1cnc(NC2(CO)CC2)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1ccccc1
Show InChI InChI=1S/C22H25N5O3/c1-14-10-24-21(27-22(13-29)7-8-22)26-19(14)16-9-17(23-11-16)20(30)25-18(12-28)15-5-3-2-4-6-15/h2-6,9-11,18,23,28-29H,7-8,12-13H2,1H3,(H,25,30)(H,24,26,27)/t18-/m1/s1
Affinity DataKi:  1nMAssay Description:Assay 1 ...More data for this Ligand-Target Pair
In DepthDetails PubMed