BDBM50373764 CHEMBL401590

SMILES: CCOC(=O)CCCN1CC[C@@]2(C)[C@@H](C)C1Cc1ccc(O)cc21

InChI Key: InChIKey=DRQSQGYYPZMJLQ-GUVZCDSQSA-N

Data: 1 EC50

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 = 50373764   

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 (MOUSE)	BDBM50373764 (CHEMBL401590) Show SMILES CCOC(=O)CCCN1CC[C@@]2(C)[C@@H](C)C1Cc1ccc(O)cc21 |w:15.16,TLB:7:8:13:17.23.16,THB:22:23:13:10.8.9| Show InChI InChI=1S/C20H29NO3/c1-4-24-19(23)6-5-10-21-11-9-20(3)14(2)18(21)12-15-7-8-16(22)13-17(15)20/h7-8,13-14,18,22H,4-6,9-12H2,1-3H3/t14-,18?,20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.79E+4	n/a	n/a	n/a	n/a
University of Maryland Curated by ChEMBL					Assay Description Agonist activity at mu opioid receptor in Swiss mouse vas deferens assessed as inhibition of electrically-stimulated twitch				Bioorg Med Chem 16: 869-73 (2008) Article DOI: 10.1016/j.bmc.2007.10.030 BindingDB Entry DOI: 10.7270/Q2XW4KN1
					More data for this Ligand-Target Pair