null

SMILES: COc1ccccc1CCCN1CC[C@](C)([C@@H](C)C1)c1cccc(O)c1

InChI Key: InChIKey=WFPPMRLHRNARMQ-FDDCHVKYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50045764   

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 (Rattus norvegicus (rat))	BDBM50045764 (3-{1-[3-(2-Methoxy-phenyl)-propyl]-3,4-dimethyl-pi...) Show SMILES COc1ccccc1CCCN1CC[C@](C)([C@@H](C)C1)c1cccc(O)c1 Show InChI InChI=1S/C23H31NO2/c1-18-17-24(14-7-9-19-8-4-5-12-22(19)26-3)15-13-23(18,2)20-10-6-11-21(25)16-20/h4-6,8,10-12,16,18,25H,7,9,13-15,17H2,1-3H3/t18-,23+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	0.950	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Binding affinity towards mu opioid receptor by displacement of [3H]-NAL from rat brain homogenates				J Med Chem 36: 2833-41 (1993) BindingDB Entry DOI: 10.7270/Q2W0951M
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50045764 (3-{1-[3-(2-Methoxy-phenyl)-propyl]-3,4-dimethyl-pi...) Show SMILES COc1ccccc1CCCN1CC[C@](C)([C@@H](C)C1)c1cccc(O)c1 Show InChI InChI=1S/C23H31NO2/c1-18-17-24(14-7-9-19-8-4-5-12-22(19)26-3)15-13-23(18,2)20-10-6-11-21(25)16-20/h4-6,8,10-12,16,18,25H,7,9,13-15,17H2,1-3H3/t18-,23+/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	53	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Binding affinity towards kappa-opioid receptor by displacement of [3H]-EKC at 10 nM from guinea pig cortical tissue				J Med Chem 36: 2833-41 (1993) BindingDB Entry DOI: 10.7270/Q2W0951M
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50045764 (3-{1-[3-(2-Methoxy-phenyl)-propyl]-3,4-dimethyl-pi...) Show SMILES COc1ccccc1CCCN1CC[C@](C)([C@@H](C)C1)c1cccc(O)c1 Show InChI InChI=1S/C23H31NO2/c1-18-17-24(14-7-9-19-8-4-5-12-22(19)26-3)15-13-23(18,2)20-10-6-11-21(25)16-20/h4-6,8,10-12,16,18,25H,7,9,13-15,17H2,1-3H3/t18-,23+/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Binding affinity towards kappa-opioid receptor by displacement of [3H]-EKC at 100 nM from guinea pig cortical tissue				J Med Chem 36: 2833-41 (1993) BindingDB Entry DOI: 10.7270/Q2W0951M
					More data for this Ligand-Target Pair