Compile Data Set for Download or QSAR
Found 3 Enz. Inhib. hit(s) with all data for entry = 50005196
TargetHistamine H3 receptor(Homo sapiens (Human))
Medical University

Curated by ChEMBL
LigandPNGBDBM50410342(CHEMBL195408)
Show SMILES C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C#N
Show InChI InChI=1S/C16H18N2O/c1-12-3-2-7-18(12)8-6-15-10-14-9-13(11-17)4-5-16(14)19-15/h4-5,9-10,12H,2-3,6-8H2,1H3/t12-/m1/s1
Affinity DataKi:  0.450nMAssay Description:Binding affinity to Homo sapiens (human) H3 receptorMore data for this Ligand-Target Pair
TargetHistamine H3 receptor(Homo sapiens (Human))
Medical University

Curated by ChEMBL
LigandPNGBDBM50159110(1-(3-(4-(piperidin-1-ylmethyl)phenoxy)propyl)piper...)
Show SMILES C(COc1ccc(CN2CCCCC2)cc1)CN1CCCCC1
Show InChI InChI=1S/C20H32N2O/c1-3-12-21(13-4-1)16-7-17-23-20-10-8-19(9-11-20)18-22-14-5-2-6-15-22/h8-11H,1-7,12-18H2
Affinity DataKi:  0.600nMAssay Description:Binding affinity to Homo sapiens (human) H3 receptorMore data for this Ligand-Target Pair
TargetHistamine H3 receptor(Rattus norvegicus (rat))
Medical University

Curated by ChEMBL
LigandPNGBDBM50458224(CHEMBL2297871)
Show SMILES O=C(C1CC1)c1ccc(OCCCN2CCCCC2)cc1
Show InChI InChI=1S/C18H25NO2/c20-18(15-5-6-15)16-7-9-17(10-8-16)21-14-4-13-19-11-2-1-3-12-19/h7-10,15H,1-6,11-14H2
Affinity DataKi:  4nMAssay Description:Binding affinity to Rattus norvegicus (rat) H3 receptorMore data for this Ligand-Target Pair