null

SMILES: [H][C@]12CN(CC3CC3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2

InChI Key: InChIKey=JANNWATVAWEGEY-DQEYMECFSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50072341   

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 (Homo sapiens (Human))	BDBM50072341 (CHEMBL3409114) Show SMILES [H][C@]12CN(CC3CC3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r| Show InChI InChI=1S/C25H31NO2/c27-21-11-12-23-22(16-21)25(13-5-4-8-19-6-2-1-3-7-19)14-15-26(17-20-9-10-20)18-24(25)28-23/h1-3,6-7,11-12,16,20,24,27H,4-5,8-10,13-15,17-18H2/t24-,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60	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]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
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50072341 (CHEMBL3409114) Show SMILES [H][C@]12CN(CC3CC3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r| Show InChI InChI=1S/C25H31NO2/c27-21-11-12-23-22(16-21)25(13-5-4-8-19-6-2-1-3-7-19)14-15-26(17-20-9-10-20)18-24(25)28-23/h1-3,6-7,11-12,16,20,24,27H,4-5,8-10,13-15,17-18H2/t24-,25-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	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))	BDBM50072341 (CHEMBL3409114) Show SMILES [H][C@]12CN(CC3CC3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r| Show InChI InChI=1S/C25H31NO2/c27-21-11-12-23-22(16-21)25(13-5-4-8-19-6-2-1-3-7-19)14-15-26(17-20-9-10-20)18-24(25)28-23/h1-3,6-7,11-12,16,20,24,27H,4-5,8-10,13-15,17-18H2/t24-,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	16	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