BDBM50291972 CHEMBL148843::N-{(S)-1-Benzyl-2-[4-(3-hydroxy-phenyl)-3,4-dimethyl-piperidin-1-yl]-ethyl}-3-(4-hydroxy-phenyl)-propionamide

SMILES: CC1CN(C[C@H](Cc2ccccc2)NC(=O)CCc2ccc(O)cc2)CCC1(C)c1cccc(O)c1

InChI Key: InChIKey=SMGWBMWVMICQEZ-NXYCWYFDSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50291972   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Mu-type opioid receptor (GUINEA PIG)	BDBM50291972 (CHEMBL148843 | N-{(S)-1-Benzyl-2-[4-(3-hydroxy-phe...) Show SMILES CC1CN(C[C@H](Cc2ccccc2)NC(=O)CCc2ccc(O)cc2)CCC1(C)c1cccc(O)c1 Show InChI InChI=1S/C31H38N2O3/c1-23-21-33(18-17-31(23,2)26-9-6-10-29(35)20-26)22-27(19-25-7-4-3-5-8-25)32-30(36)16-13-24-11-14-28(34)15-12-24/h3-12,14-15,20,23,27,34-35H,13,16-19,21-22H2,1-2H3,(H,32,36)/t23?,27-,31?/m0/s1	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Binding affinity determined on Opioid receptor mu 1 in Guinea pig brain membranes using radioligand [3H]DAMGO.				J Med Chem 41: 5188-97 (1999) Article DOI: 10.1021/jm980511k BindingDB Entry DOI: 10.7270/Q2P26ZT4
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50291972 (CHEMBL148843 | N-{(S)-1-Benzyl-2-[4-(3-hydroxy-phe...) Show SMILES CC1CN(C[C@H](Cc2ccccc2)NC(=O)CCc2ccc(O)cc2)CCC1(C)c1cccc(O)c1 Show InChI InChI=1S/C31H38N2O3/c1-23-21-33(18-17-31(23,2)26-9-6-10-29(35)20-26)22-27(19-25-7-4-3-5-8-25)32-30(36)16-13-24-11-14-28(34)15-12-24/h3-12,14-15,20,23,27,34-35H,13,16-19,21-22H2,1-2H3,(H,32,36)/t23?,27-,31?/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	55	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Binding affinity determined on Opioid receptor kappa 1 in Guinea pig brain membranes using radioligand [3H]U-69593				J Med Chem 41: 5188-97 (1999) Article DOI: 10.1021/jm980511k BindingDB Entry DOI: 10.7270/Q2P26ZT4
					More data for this Ligand-Target Pair