BDBM50177689 3-(trans-4,5-dimethyl-1-phenethyl-2-alpha-phenylpiperidin-4-yl)phenol::CHEMBL201480

SMILES: C[C@H]1CN(CCc2ccccc2)[C@@H](C[C@@]1(C)c1cccc(O)c1)c1ccccc1

InChI Key: InChIKey=OSWHXGQRTJIDDD-NJTBCWBZSA-N

Data: 3 KI  1 IC50

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 4 hits for monomerid = 50177689   

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
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50177689 (3-(trans-4,5-dimethyl-1-phenethyl-2-alpha-phenylpi...) Show SMILES C[C@H]1CN(CCc2ccccc2)[C@@H](C[C@@]1(C)c1cccc(O)c1)c1ccccc1 Show InChI InChI=1S/C27H31NO/c1-21-20-28(17-16-22-10-5-3-6-11-22)26(23-12-7-4-8-13-23)19-27(21,2)24-14-9-15-25(29)18-24/h3-15,18,21,26,29H,16-17,19-20H2,1-2H3/t21-,26-,27+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	260	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Displacement of [3H]diprenorphine from human cloned delta opioid receptor				Bioorg Med Chem Lett 16: 864-8 (2006) Article DOI: 10.1016/j.bmcl.2005.11.010 BindingDB Entry DOI: 10.7270/Q2RJ4J1J
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50177689 (3-(trans-4,5-dimethyl-1-phenethyl-2-alpha-phenylpi...) Show SMILES C[C@H]1CN(CCc2ccccc2)[C@@H](C[C@@]1(C)c1cccc(O)c1)c1ccccc1 Show InChI InChI=1S/C27H31NO/c1-21-20-28(17-16-22-10-5-3-6-11-22)26(23-12-7-4-8-13-23)19-27(21,2)24-14-9-15-25(29)18-24/h3-15,18,21,26,29H,16-17,19-20H2,1-2H3/t21-,26-,27+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	280	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Displacement of [3H]diprenorphine from human cloned mu opioid receptor				Bioorg Med Chem Lett 16: 864-8 (2006) Article DOI: 10.1016/j.bmcl.2005.11.010 BindingDB Entry DOI: 10.7270/Q2RJ4J1J
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50177689 (3-(trans-4,5-dimethyl-1-phenethyl-2-alpha-phenylpi...) Show SMILES C[C@H]1CN(CCc2ccccc2)[C@@H](C[C@@]1(C)c1cccc(O)c1)c1ccccc1 Show InChI InChI=1S/C27H31NO/c1-21-20-28(17-16-22-10-5-3-6-11-22)26(23-12-7-4-8-13-23)19-27(21,2)24-14-9-15-25(29)18-24/h3-15,18,21,26,29H,16-17,19-20H2,1-2H3/t21-,26-,27+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	290	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Displacement of [3H]diprenorphine from human cloned kappa opioid receptor				Bioorg Med Chem Lett 16: 864-8 (2006) Article DOI: 10.1016/j.bmcl.2005.11.010 BindingDB Entry DOI: 10.7270/Q2RJ4J1J
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50177689 (3-(trans-4,5-dimethyl-1-phenethyl-2-alpha-phenylpi...) Show SMILES C[C@H]1CN(CCc2ccccc2)[C@@H](C[C@@]1(C)c1cccc(O)c1)c1ccccc1 Show InChI InChI=1S/C27H31NO/c1-21-20-28(17-16-22-10-5-3-6-11-22)26(23-12-7-4-8-13-23)19-27(21,2)24-14-9-15-25(29)18-24/h3-15,18,21,26,29H,16-17,19-20H2,1-2H3/t21-,26-,27+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of loperamide-stimulated [35S]GTPgammaS binding to membranes containing mu opioid receptor				Bioorg Med Chem Lett 16: 864-8 (2006) Article DOI: 10.1016/j.bmcl.2005.11.010 BindingDB Entry DOI: 10.7270/Q2RJ4J1J
					More data for this Ligand-Target Pair