BDBM50453067 CHEMBL2367762

SMILES: [H][C@]12Cc3ccc(O)cc3[C@@](C)(CCN1C[C@H]1OC(=O)C=C1)[C@H]2C

InChI Key: InChIKey=USMLAOXPTZITDG-FRXJQCMVSA-N

Data: 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 1 hit for monomerid = 50453067   

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
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50453067 (CHEMBL2367762) Show SMILES [H][C@]12Cc3ccc(O)cc3[C@@](C)(CCN1C[C@H]1OC(=O)C=C1)[C@H]2C |r,c:22,THB:8:9:22:14.12.13,15:14:22:9.3.2| Show InChI InChI=1S/C19H23NO3/c1-12-17-9-13-3-4-14(21)10-16(13)19(12,2)7-8-20(17)11-15-5-6-18(22)23-15/h3-6,10,12,15,17,21H,7-9,11H2,1-2H3/t12-,15-,17+,19-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.40	n/a	n/a	n/a	n/a	n/a	n/a
University of Washington Curated by ChEMBL					Assay Description Displacement of [3H]-bremazocine from opioid receptor kappa of guinea pig membrane.				J Med Chem 34: 2438-44 (1991) BindingDB Entry DOI: 10.7270/Q2NC605T
					More data for this Ligand-Target Pair