BDBM50300371 4aR,9aS,2'R-(+)-cis-2-(2'-Hydroxy-2'-phenylethyl)-4a-ethyl-1,2,3,4,4a,9a-hexahydrobenzofuro[2,3-c]pyridin-6-ol::CHEMBL566557

SMILES: CC[C@]12CCN(C[C@H](O)c3ccccc3)C[C@H]1Oc1ccc(O)cc21

InChI Key: InChIKey=IWQGUHXUWMPTNL-CEWLAPEOSA-N

Data: 3 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 3 hits for monomerid = 50300371   

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))	BDBM50300371 (4aR,9aS,2'R-(+)-cis-2-(2'-Hydroxy-2'-phenylethyl)-...) Show SMILES CC[C@]12CCN(C[C@H](O)c3ccccc3)C[C@H]1Oc1ccc(O)cc21 |r| Show InChI InChI=1S/C21H25NO3/c1-2-21-10-11-22(13-18(24)15-6-4-3-5-7-15)14-20(21)25-19-9-8-16(23)12-17(19)21/h3-9,12,18,20,23-24H,2,10-11,13-14H2,1H3/t18-,20+,21+/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	1.33E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholi Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from human recombinant mu opioid receptor expressed in CHO cells				J Med Chem 52: 7570-9 (2009) Article DOI: 10.1021/jm9004225 BindingDB Entry DOI: 10.7270/Q2FF3SFM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50300371 (4aR,9aS,2'R-(+)-cis-2-(2'-Hydroxy-2'-phenylethyl)-...) Show SMILES CC[C@]12CCN(C[C@H](O)c3ccccc3)C[C@H]1Oc1ccc(O)cc21 |r| Show InChI InChI=1S/C21H25NO3/c1-2-21-10-11-22(13-18(24)15-6-4-3-5-7-15)14-20(21)25-19-9-8-16(23)12-17(19)21/h3-9,12,18,20,23-24H,2,10-11,13-14H2,1H3/t18-,20+,21+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholi Curated by ChEMBL					Assay Description Displacement of [3H]DADLE from human recombinant delta opioid receptor expressed in CHO cells				J Med Chem 52: 7570-9 (2009) Article DOI: 10.1021/jm9004225 BindingDB Entry DOI: 10.7270/Q2FF3SFM
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50300371 (4aR,9aS,2'R-(+)-cis-2-(2'-Hydroxy-2'-phenylethyl)-...) Show SMILES CC[C@]12CCN(C[C@H](O)c3ccccc3)C[C@H]1Oc1ccc(O)cc21 |r| Show InChI InChI=1S/C21H25NO3/c1-2-21-10-11-22(13-18(24)15-6-4-3-5-7-15)14-20(21)25-19-9-8-16(23)12-17(19)21/h3-9,12,18,20,23-24H,2,10-11,13-14H2,1H3/t18-,20+,21+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholi Curated by ChEMBL					Assay Description Displacement of [3H]U69593 from human recombinant kappa opioid receptor expressed in CHO cells				J Med Chem 52: 7570-9 (2009) Article DOI: 10.1021/jm9004225 BindingDB Entry DOI: 10.7270/Q2FF3SFM
					More data for this Ligand-Target Pair