Compile Data Set for Download or QSAR
Found 2 Enz. Inhib. hit(s) with all data for entry = 50039356
TargetMacrophage metalloelastase(Homo sapiens (Human))
P. Angeletti S.p.A. (Merck Research Laboratories)

Curated by ChEMBL
LigandPNGBDBM50335314((7R)-14-cyclohexyl-7-{[2-(dimethylamino)ethyl](met...)
Show SMILES CN(C)CCN(C)[C@H]1COc2ccccc2-c2c(C3CCCCC3)c3ccc(cc3n2C1)C(O)=O
Show InChI InChI=1S/C29H37N3O3/c1-30(2)15-16-31(3)22-18-32-25-17-21(29(33)34)13-14-23(25)27(20-9-5-4-6-10-20)28(32)24-11-7-8-12-26(24)35-19-22/h7-8,11-14,17,20,22H,4-6,9-10,15-16,18-19H2,1-3H3,(H,33,34)/t22-/m1/s1
Affinity DataIC50: 8.30E+3nMAssay Description:Inhibition of MMP12More data for this Ligand-Target Pair
TargetProtein kinase C alpha type(Homo sapiens (Human))
P. Angeletti S.p.A. (Merck Research Laboratories)

Curated by ChEMBL
LigandPNGBDBM50335314((7R)-14-cyclohexyl-7-{[2-(dimethylamino)ethyl](met...)
Show SMILES CN(C)CCN(C)[C@H]1COc2ccccc2-c2c(C3CCCCC3)c3ccc(cc3n2C1)C(O)=O
Show InChI InChI=1S/C29H37N3O3/c1-30(2)15-16-31(3)22-18-32-25-17-21(29(33)34)13-14-23(25)27(20-9-5-4-6-10-20)28(32)24-11-7-8-12-26(24)35-19-22/h7-8,11-14,17,20,22H,4-6,9-10,15-16,18-19H2,1-3H3,(H,33,34)/t22-/m1/s1
Affinity DataIC50: 5.90E+4nMAssay Description:Inhibition of PKCalphaMore data for this Ligand-Target Pair