BDBM50000570 3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol::CHEMBL285250

SMILES: CN1CCC2(CCCC1C2)c1cccc(O)c1

InChI Key: InChIKey=ZQJGRSYDDMBMPJ-UHFFFAOYSA-N

Data: 10 KI  7 IC50

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 17 hits for monomerid = 50000570   

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 opioid receptor (CALF)	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	3.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity towards opioid receptor mu 1				J Med Chem 35: 1521-5 (1992) BindingDB Entry DOI: 10.7270/Q22806JN
					More data for this Ligand-Target Pair
Mu opioid receptor (CALF)	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity towards opioid receptor mu 1				J Med Chem 35: 1521-5 (1992) BindingDB Entry DOI: 10.7270/Q22806JN
					More data for this Ligand-Target Pair
Mu opioid receptor (CALF)	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity towards opioid receptor mu 2				J Med Chem 35: 1521-5 (1992) BindingDB Entry DOI: 10.7270/Q22806JN
					More data for this Ligand-Target Pair
Mu opioid receptor (CALF)	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity of the compound towards opioid receptor mu 2				J Med Chem 35: 1521-5 (1992) BindingDB Entry DOI: 10.7270/Q22806JN
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	78	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity of the compound towards Opioid receptor kappa 2				J Med Chem 35: 1521-5 (1992) BindingDB Entry DOI: 10.7270/Q22806JN
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	98	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity of the compound towards opioid receptor kappa 1				J Med Chem 35: 1521-5 (1992) BindingDB Entry DOI: 10.7270/Q22806JN
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity of the compound towards opioid receptor kappa 2				J Med Chem 35: 1521-5 (1992) BindingDB Entry DOI: 10.7270/Q22806JN
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity of the compound towards opioid receptor mu 2				J Med Chem 35: 1521-5 (1992) BindingDB Entry DOI: 10.7270/Q22806JN
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	>500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity of the compound towards opioid receptor mu 2				J Med Chem 35: 1521-5 (1992) BindingDB Entry DOI: 10.7270/Q22806JN
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	>500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Binding affinity of the compound towards Opioid receptor delta 1				J Med Chem 35: 1521-5 (1992) BindingDB Entry DOI: 10.7270/Q22806JN
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Inhibition of [3H]DAMGO radioligand binding to rat brain opioid receptor mu 1.				J Med Chem 38: 1523-37 (1995) BindingDB Entry DOI: 10.7270/Q2MG7Q5M
					More data for this Ligand-Target Pair
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Inhibition of [3H]DADLE radioligand binding to rat brain opioid receptor delta 1.				J Med Chem 38: 1523-37 (1995) BindingDB Entry DOI: 10.7270/Q2MG7Q5M
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Inhibition of [3H]DAMGO radioligand binding to rat brain opioid receptor mu 1.				J Med Chem 38: 1523-37 (1995) BindingDB Entry DOI: 10.7270/Q2MG7Q5M
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	639	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description The opioid activity against the mu-receptor in the isolated guinea pig ileum(GPI)				J Med Chem 38: 1523-37 (1995) BindingDB Entry DOI: 10.7270/Q2MG7Q5M
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	911	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Inhibition of [3H]U-69593 radioligand binding to Guinea pig opioid receptor kappa 1.				J Med Chem 38: 1523-37 (1995) BindingDB Entry DOI: 10.7270/Q2MG7Q5M
					More data for this Ligand-Target Pair
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Inhibition of [3H]DADLE radioligand binding to rat brain opioid receptor delta 1.				J Med Chem 38: 1523-37 (1995) BindingDB Entry DOI: 10.7270/Q2MG7Q5M
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50000570 (3-(2-Methyl-2-aza-bicyclo[3.3.1]non-5-yl)-phenol |...) Show SMILES CN1CCC2(CCCC1C2)c1cccc(O)c1 |THB:0:1:9:5.7.6| Show InChI InChI=1S/C15H21NO/c1-16-9-8-15(7-3-5-13(16)11-15)12-4-2-6-14(17)10-12/h2,4,6,10,13,17H,3,5,7-9,11H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	557	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Opioid activity against delta-receptor of isolated mouse vas deferens(MVD) at 30 uM				J Med Chem 38: 1523-37 (1995) BindingDB Entry DOI: 10.7270/Q2MG7Q5M
					More data for this Ligand-Target Pair