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SMILES: [H][C@]12Cc3cc4sc(N)nc4cc3[C@@](C)(CCN1CC1CC1)[C@H]2C

InChI Key: InChIKey=RHBKARCWDMDZOJ-MAAWUACBSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50458138   

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))	BDBM50458138 (CHEMBL4203753) Show SMILES [H][C@]12Cc3cc4sc(N)nc4cc3[C@@](C)(CCN1CC1CC1)[C@H]2C |r,THB:11:12:22:15.16.17,18:17:22:3.12.2| Show InChI InChI=1S/C19H25N3S/c1-11-16-7-13-8-17-15(21-18(20)23-17)9-14(13)19(11,2)5-6-22(16)10-12-3-4-12/h8-9,11-12,16H,3-7,10H2,1-2H3,(H2,20,21)/t11-,16+,19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Catania Curated by ChEMBL					Assay Description Displacement of [3H]U69,593 from KOR (unknown origin) expressed in CHO cell membranes				Eur J Med Chem 148: 410-422 (2018) Article DOI: 10.1016/j.ejmech.2018.02.046 BindingDB Entry DOI: 10.7270/Q2QR50SX
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50458138 (CHEMBL4203753) Show SMILES [H][C@]12Cc3cc4sc(N)nc4cc3[C@@](C)(CCN1CC1CC1)[C@H]2C |r,THB:11:12:22:15.16.17,18:17:22:3.12.2| Show InChI InChI=1S/C19H25N3S/c1-11-16-7-13-8-17-15(21-18(20)23-17)9-14(13)19(11,2)5-6-22(16)10-12-3-4-12/h8-9,11-12,16H,3-7,10H2,1-2H3,(H2,20,21)/t11-,16+,19-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	48	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Catania Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from MOR (unknown origin) expressed in CHO cell membranes				Eur J Med Chem 148: 410-422 (2018) Article DOI: 10.1016/j.ejmech.2018.02.046 BindingDB Entry DOI: 10.7270/Q2QR50SX
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50458138 (CHEMBL4203753) Show SMILES [H][C@]12Cc3cc4sc(N)nc4cc3[C@@](C)(CCN1CC1CC1)[C@H]2C |r,THB:11:12:22:15.16.17,18:17:22:3.12.2| Show InChI InChI=1S/C19H25N3S/c1-11-16-7-13-8-17-15(21-18(20)23-17)9-14(13)19(11,2)5-6-22(16)10-12-3-4-12/h8-9,11-12,16H,3-7,10H2,1-2H3,(H2,20,21)/t11-,16+,19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	940	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Catania Curated by ChEMBL					Assay Description Displacement of [3H]naltrindole from DOR (unknown origin) expressed in CHO cell membranes				Eur J Med Chem 148: 410-422 (2018) Article DOI: 10.1016/j.ejmech.2018.02.046 BindingDB Entry DOI: 10.7270/Q2QR50SX
					More data for this Ligand-Target Pair