BDBM50177700 3-(2-alpha-isopropyl-trans-4,5-dimethyl-1-phenethylpiperidin-4-yl)phenol::CHEMBL425758

SMILES: CC(C)[C@@H]1C[C@](C)([C@@H](C)CN1CCc1ccccc1)c1cccc(O)c1

InChI Key: InChIKey=LUDLDYBUCPLMCL-WDJPJFJCSA-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 = 50177700   

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 (Homo sapiens (Human))	BDBM50177700 (3-(2-alpha-isopropyl-trans-4,5-dimethyl-1-phenethy...) Show SMILES CC(C)[C@@H]1C[C@](C)([C@@H](C)CN1CCc1ccccc1)c1cccc(O)c1 Show InChI InChI=1S/C24H33NO/c1-18(2)23-16-24(4,21-11-8-12-22(26)15-21)19(3)17-25(23)14-13-20-9-6-5-7-10-20/h5-12,15,18-19,23,26H,13-14,16-17H2,1-4H3/t19-,23-,24+/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	270	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of loperamide-stimulated [35S]GTP-gamma-S 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
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50177700 (3-(2-alpha-isopropyl-trans-4,5-dimethyl-1-phenethy...) Show SMILES CC(C)[C@@H]1C[C@](C)([C@@H](C)CN1CCc1ccccc1)c1cccc(O)c1 Show InChI InChI=1S/C24H33NO/c1-18(2)23-16-24(4,21-11-8-12-22(26)15-21)19(3)17-25(23)14-13-20-9-6-5-7-10-20/h5-12,15,18-19,23,26H,13-14,16-17H2,1-4H3/t19-,23-,24+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+3	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
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50177700 (3-(2-alpha-isopropyl-trans-4,5-dimethyl-1-phenethy...) Show SMILES CC(C)[C@@H]1C[C@](C)([C@@H](C)CN1CCc1ccccc1)c1cccc(O)c1 Show InChI InChI=1S/C24H33NO/c1-18(2)23-16-24(4,21-11-8-12-22(26)15-21)19(3)17-25(23)14-13-20-9-6-5-7-10-20/h5-12,15,18-19,23,26H,13-14,16-17H2,1-4H3/t19-,23-,24+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+3	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))	BDBM50177700 (3-(2-alpha-isopropyl-trans-4,5-dimethyl-1-phenethy...) Show SMILES CC(C)[C@@H]1C[C@](C)([C@@H](C)CN1CCc1ccccc1)c1cccc(O)c1 Show InChI InChI=1S/C24H33NO/c1-18(2)23-16-24(4,21-11-8-12-22(26)15-21)19(3)17-25(23)14-13-20-9-6-5-7-10-20/h5-12,15,18-19,23,26H,13-14,16-17H2,1-4H3/t19-,23-,24+/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	620	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