Compile Data Set for Download or QSAR
Found 2 Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 1' and Ligand = 'BDBM92096'
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92096(erk000525)
Show SMILES CC(C)CNc1ncc(C)c(n1)-c1c[nH]c(c1)C(=O)N[C@H](CO)c1cccc(Cl)c1
Show InChI InChI=1S/C22H26ClN5O2/c1-13(2)9-25-22-26-10-14(3)20(28-22)16-8-18(24-11-16)21(30)27-19(12-29)15-5-4-6-17(23)7-15/h4-8,10-11,13,19,24,29H,9,12H2,1-3H3,(H,27,30)(H,25,26,28)/t19-/m1/s1
Affinity DataKi:  3nMAssay Description:Photometric_Method2More data for this Ligand-Target Pair
In DepthDetails PubMed
TargetMitogen-activated protein kinase 1(Homo sapiens (Human))
D3R

LigandPNGBDBM92096(erk000525)
Show SMILES CC(C)CNc1ncc(C)c(n1)-c1c[nH]c(c1)C(=O)N[C@H](CO)c1cccc(Cl)c1
Show InChI InChI=1S/C22H26ClN5O2/c1-13(2)9-25-22-26-10-14(3)20(28-22)16-8-18(24-11-16)21(30)27-19(12-29)15-5-4-6-17(23)7-15/h4-8,10-11,13,19,24,29H,9,12H2,1-3H3,(H,27,30)(H,25,26,28)/t19-/m1/s1
Affinity DataKi:  3nMAssay Description:Assay 1 ...More data for this Ligand-Target Pair
In DepthDetails PubMed