BDBM50038642 22-methyl-(2R,13S)-14-oxa-4,22-diazaheptacyclo[13.9.1.01,13.02,21.03,11.05,10.019,25]pentacosa-3(11),5(10),6,8,15,17,19(25)-heptaen-16-ol::CHEMBL291973

SMILES: CN1CC[C@]23[C@@H]4Cc5c([nH]c6ccccc56)[C@H]2[C@H]1Cc1ccc(O)c(O4)c31

InChI Key: InChIKey=TVTQHEAJUSXWSV-RWSUSOHTSA-N

Data: 3 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 3 hits for monomerid = 50038642   

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 (GUINEA PIG)	BDBM50038642 (22-methyl-(2R,13S)-14-oxa-4,22-diazaheptacyclo[13....) Show SMILES CN1CC[C@]23[C@@H]4Cc5c([nH]c6ccccc56)[C@H]2[C@H]1Cc1ccc(O)c(O4)c31 Show InChI InChI=1S/C23H22N2O2/c1-25-9-8-23-18-11-14-13-4-2-3-5-15(13)24-21(14)20(23)16(25)10-12-6-7-17(26)22(27-18)19(12)23/h2-7,16,18,20,24,26H,8-11H2,1H3/t16-,18+,20-,23-/m1/s1	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	920	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Antagonist activity against mu-opioid receptor in guinea pig ileum in the presence of morphine				J Med Chem 37: 1886-8 (1994) BindingDB Entry DOI: 10.7270/Q20G3KRG
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50038642 (22-methyl-(2R,13S)-14-oxa-4,22-diazaheptacyclo[13....) Show SMILES CN1CC[C@]23[C@@H]4Cc5c([nH]c6ccccc56)[C@H]2[C@H]1Cc1ccc(O)c(O4)c31 Show InChI InChI=1S/C23H22N2O2/c1-25-9-8-23-18-11-14-13-4-2-3-5-15(13)24-21(14)20(23)16(25)10-12-6-7-17(26)22(27-18)19(12)23/h2-7,16,18,20,24,26H,8-11H2,1H3/t16-,18+,20-,23-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Antagonist activity against delta-opioid receptor in mouse vas deferens in the presence of DADLE				J Med Chem 37: 1886-8 (1994) BindingDB Entry DOI: 10.7270/Q20G3KRG
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50038642 (22-methyl-(2R,13S)-14-oxa-4,22-diazaheptacyclo[13....) Show SMILES CN1CC[C@]23[C@@H]4Cc5c([nH]c6ccccc56)[C@H]2[C@H]1Cc1ccc(O)c(O4)c31 Show InChI InChI=1S/C23H22N2O2/c1-25-9-8-23-18-11-14-13-4-2-3-5-15(13)24-21(14)20(23)16(25)10-12-6-7-17(26)22(27-18)19(12)23/h2-7,16,18,20,24,26H,8-11H2,1H3/t16-,18+,20-,23-/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	990	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Antagonist activity against kappa-opioid receptor in guinea pig ileum in the presence of ethylketazocine				J Med Chem 37: 1886-8 (1994) BindingDB Entry DOI: 10.7270/Q20G3KRG
					More data for this Ligand-Target Pair