BDBM50106348 CHEMBL610012

SMILES: [H][C@@]12Oc3c4c(C[C@@]5([H])N(CC6CC6)CC[C@@]14[C@@]5(O)Cc1cc4ccccc4nc21)ccc3O

InChI Key: InChIKey=HTYCDZLDBAZXNO-NVSKSXHLSA-N

Data: 3 KI  1 EC50

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 4 hits for monomerid = 50106348   

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
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50106348 (CHEMBL610012) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(CC6CC6)CC[C@@]14[C@@]5(O)Cc1cc4ccccc4nc21)ccc3O |r,THB:10:9:17:4.5.6| Show InChI InChI=1S/C27H26N2O3/c30-20-8-7-17-12-21-27(31)13-18-11-16-3-1-2-4-19(16)28-23(18)25-26(27,22(17)24(20)32-25)9-10-29(21)14-15-5-6-15/h1-4,7-8,11,15,21,25,30-31H,5-6,9-10,12-14H2/t21-,25+,26+,27-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.407	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Displacement of [3H]DPDPE from human DOR expressed in CHO cells				Bioorg Med Chem Lett 25: 2927-30 (2015) BindingDB Entry DOI: 10.7270/Q28C9Z0W
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50106348 (CHEMBL610012) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(CC6CC6)CC[C@@]14[C@@]5(O)Cc1cc4ccccc4nc21)ccc3O |r,THB:10:9:17:4.5.6| Show InChI InChI=1S/C27H26N2O3/c30-20-8-7-17-12-21-27(31)13-18-11-16-3-1-2-4-19(16)28-23(18)25-26(27,22(17)24(20)32-25)9-10-29(21)14-15-5-6-15/h1-4,7-8,11,15,21,25,30-31H,5-6,9-10,12-14H2/t21-,25+,26+,27-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Displacement of [3H]U-69,593 from human KOR expressed in CHO cells				Bioorg Med Chem Lett 25: 2927-30 (2015) BindingDB Entry DOI: 10.7270/Q28C9Z0W
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50106348 (CHEMBL610012) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(CC6CC6)CC[C@@]14[C@@]5(O)Cc1cc4ccccc4nc21)ccc3O |r,THB:10:9:17:4.5.6| Show InChI InChI=1S/C27H26N2O3/c30-20-8-7-17-12-21-27(31)13-18-11-16-3-1-2-4-19(16)28-23(18)25-26(27,22(17)24(20)32-25)9-10-29(21)14-15-5-6-15/h1-4,7-8,11,15,21,25,30-31H,5-6,9-10,12-14H2/t21-,25+,26+,27-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from human MOR expressed in CHO cells				Bioorg Med Chem Lett 25: 2927-30 (2015) BindingDB Entry DOI: 10.7270/Q28C9Z0W
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50106348 (CHEMBL610012) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(CC6CC6)CC[C@@]14[C@@]5(O)Cc1cc4ccccc4nc21)ccc3O |r,THB:10:9:17:4.5.6| Show InChI InChI=1S/C27H26N2O3/c30-20-8-7-17-12-21-27(31)13-18-11-16-3-1-2-4-19(16)28-23(18)25-26(27,22(17)24(20)32-25)9-10-29(21)14-15-5-6-15/h1-4,7-8,11,15,21,25,30-31H,5-6,9-10,12-14H2/t21-,25+,26+,27-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	9.80	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Inverse agonist activity at human DOR expressed in CHO cell membranes by [35S]GTPgammaS binding assay				Bioorg Med Chem Lett 25: 2927-30 (2015) BindingDB Entry DOI: 10.7270/Q28C9Z0W
					More data for this Ligand-Target Pair