BDBM50096951 1'-{5-(3,5-Bis-trifluoromethyl-benzyloxy)-3-(3,4-dichloro-phenyl)-4-[(Z)-methoxyimino]-pentyl}-[1,4']bipiperidinyl-3-carboxylic acid amide::CHEMBL342341

SMILES CO\N=C(/COCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(CCN1CCC(CC1)N1CCCC(C1)C(N)=O)c1ccc(Cl)c(Cl)c1

InChI Key InChIKey=ASXZZPJDUJGTRI-JSKGAOECSA-N

Data  2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50096951   

TargetSubstance-K receptor(Homo sapiens (Human))
Schering-Plough Research Institute

Curated by ChEMBL
LigandPNGBDBM50096951(1'-{5-(3,5-Bis-trifluoromethyl-benzyloxy)-3-(3,4-d...)
Show SMILES CO\N=C(/COCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(CCN1CCC(CC1)N1CCCC(C1)C(N)=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C32H38Cl2F6N4O3/c1-46-42-29(19-47-18-20-13-23(31(35,36)37)16-24(14-20)32(38,39)40)26(21-4-5-27(33)28(34)15-21)8-12-43-10-6-25(7-11-43)44-9-2-3-22(17-44)30(41)45/h4-5,13-16,22,25-26H,2-3,6-12,17-19H2,1H3,(H2,41,45)/b42-29+
Affinity DataKi:  11nMAssay Description:Binding affinity towards NK2 receptorMore data for this Ligand-Target Pair
TargetSubstance-P receptor(Homo sapiens (Human))
Schering-Plough Research Institute

Curated by ChEMBL
LigandPNGBDBM50096951(1'-{5-(3,5-Bis-trifluoromethyl-benzyloxy)-3-(3,4-d...)
Show SMILES CO\N=C(/COCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(CCN1CCC(CC1)N1CCCC(C1)C(N)=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C32H38Cl2F6N4O3/c1-46-42-29(19-47-18-20-13-23(31(35,36)37)16-24(14-20)32(38,39)40)26(21-4-5-27(33)28(34)15-21)8-12-43-10-6-25(7-11-43)44-9-2-3-22(17-44)30(41)45/h4-5,13-16,22,25-26H,2-3,6-12,17-19H2,1H3,(H2,41,45)/b42-29+
Affinity DataKi:  13nMAssay Description:Binding affinity towards NK1 receptorMore data for this Ligand-Target Pair