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SMILES: [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2

InChI Key: InChIKey=VVAUJGRUARTNBV-KYJUHHDHSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50072334   

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))	BDBM50072334 (CHEMBL3409118) Show SMILES [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r| Show InChI InChI=1S/C30H35NO2/c32-26-15-16-28-27(22-26)30(18-9-3-8-12-24-10-4-1-5-11-24)19-21-31(23-29(30)33-28)20-17-25-13-6-2-7-14-25/h1-2,4-7,10-11,13-16,22,29,32H,3,8-9,12,17-21,23H2/t29-,30-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	5.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...				Eur J Med Chem 92: 531-9 (2015) Article DOI: 10.1016/j.ejmech.2015.01.025 BindingDB Entry DOI: 10.7270/Q2GF0W6W
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50072334 (CHEMBL3409118) Show SMILES [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r| Show InChI InChI=1S/C30H35NO2/c32-26-15-16-28-27(22-26)30(18-9-3-8-12-24-10-4-1-5-11-24)19-21-31(23-29(30)33-28)20-17-25-13-6-2-7-14-25/h1-2,4-7,10-11,13-16,22,29,32H,3,8-9,12,17-21,23H2/t29-,30-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse Curated by ChEMBL					Assay Description Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...				Eur J Med Chem 92: 531-9 (2015) Article DOI: 10.1016/j.ejmech.2015.01.025 BindingDB Entry DOI: 10.7270/Q2GF0W6W
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50072334 (CHEMBL3409118) Show SMILES [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r| Show InChI InChI=1S/C30H35NO2/c32-26-15-16-28-27(22-26)30(18-9-3-8-12-24-10-4-1-5-11-24)19-21-31(23-29(30)33-28)20-17-25-13-6-2-7-14-25/h1-2,4-7,10-11,13-16,22,29,32H,3,8-9,12,17-21,23H2/t29-,30-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	82	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse Curated by ChEMBL					Assay Description Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...				Eur J Med Chem 92: 531-9 (2015) Article DOI: 10.1016/j.ejmech.2015.01.025 BindingDB Entry DOI: 10.7270/Q2GF0W6W
					More data for this Ligand-Target Pair