BDBM50148910 CHEMBL3770668

SMILES: Cc1cc(O)ccc1C[C@H](N)C(=O)N[C@@H]1CCNc2ccc(Cc3ccccc3)cc12

InChI Key: InChIKey=POSRSBGSQMKPAD-UKILVPOCSA-N

Data: 3 KI  2 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 5 hits for monomerid = 50148910   

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))	BDBM50148910 (CHEMBL3770668) Show SMILES Cc1cc(O)ccc1C[C@H](N)C(=O)N[C@@H]1CCNc2ccc(Cc3ccccc3)cc12 |r| Show InChI InChI=1S/C26H29N3O2/c1-17-13-21(30)9-8-20(17)16-23(27)26(31)29-25-11-12-28-24-10-7-19(15-22(24)25)14-18-5-3-2-4-6-18/h2-10,13,15,23,25,28,30H,11-12,14,16,27H2,1H3,(H,29,31)/t23-,25+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	1.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]diprenorphine from rat MOR expressed in rat C6 cells after 1 hr by liquid scintillation counting method				ACS Med Chem Lett 6: 1199-203 (2015) BindingDB Entry DOI: 10.7270/Q20V8FN5
					More data for this Ligand-Target Pair
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50148910 (CHEMBL3770668) Show SMILES Cc1cc(O)ccc1C[C@H](N)C(=O)N[C@@H]1CCNc2ccc(Cc3ccccc3)cc12 |r| Show InChI InChI=1S/C26H29N3O2/c1-17-13-21(30)9-8-20(17)16-23(27)26(31)29-25-11-12-28-24-10-7-19(15-22(24)25)14-18-5-3-2-4-6-18/h2-10,13,15,23,25,28,30H,11-12,14,16,27H2,1H3,(H,29,31)/t23-,25+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]diprenorphine from rat DOR expressed in rat C6 cells after 1 hr by liquid scintillation counting method				ACS Med Chem Lett 6: 1199-203 (2015) BindingDB Entry DOI: 10.7270/Q20V8FN5
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50148910 (CHEMBL3770668) Show SMILES Cc1cc(O)ccc1C[C@H](N)C(=O)N[C@@H]1CCNc2ccc(Cc3ccccc3)cc12 |r| Show InChI InChI=1S/C26H29N3O2/c1-17-13-21(30)9-8-20(17)16-23(27)26(31)29-25-11-12-28-24-10-7-19(15-22(24)25)14-18-5-3-2-4-6-18/h2-10,13,15,23,25,28,30H,11-12,14,16,27H2,1H3,(H,29,31)/t23-,25+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	96	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]diprenorphine from human KOR expressed in CHO cells after 1 hr by liquid scintillation counting method				ACS Med Chem Lett 6: 1199-203 (2015) BindingDB Entry DOI: 10.7270/Q20V8FN5
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50148910 (CHEMBL3770668) Show SMILES Cc1cc(O)ccc1C[C@H](N)C(=O)N[C@@H]1CCNc2ccc(Cc3ccccc3)cc12 |r| Show InChI InChI=1S/C26H29N3O2/c1-17-13-21(30)9-8-20(17)16-23(27)26(31)29-25-11-12-28-24-10-7-19(15-22(24)25)14-18-5-3-2-4-6-18/h2-10,13,15,23,25,28,30H,11-12,14,16,27H2,1H3,(H,29,31)/t23-,25+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Agonist activity at human KOR expressed in CHO cells after 1 hr by [35S]GTPgammaS binding assay				ACS Med Chem Lett 6: 1199-203 (2015) BindingDB Entry DOI: 10.7270/Q20V8FN5
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50148910 (CHEMBL3770668) Show SMILES Cc1cc(O)ccc1C[C@H](N)C(=O)N[C@@H]1CCNc2ccc(Cc3ccccc3)cc12 |r| Show InChI InChI=1S/C26H29N3O2/c1-17-13-21(30)9-8-20(17)16-23(27)26(31)29-25-11-12-28-24-10-7-19(15-22(24)25)14-18-5-3-2-4-6-18/h2-10,13,15,23,25,28,30H,11-12,14,16,27H2,1H3,(H,29,31)/t23-,25+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	44	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Agonist activity at rat MOR expressed in rat C6 cells after 1 hr by [35S]GTPgammaS binding assay				ACS Med Chem Lett 6: 1199-203 (2015) BindingDB Entry DOI: 10.7270/Q20V8FN5
					More data for this Ligand-Target Pair