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SMILES: Clc1ccc2C3C4CCC(N4)C3CCc2n1

InChI Key: InChIKey=YFIIBDQLLAQNAF-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50474544   

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
Neuronal acetylcholine receptor subunit alpha-2/beta-4 (Rattus norvegicus (Rat))	BDBM50474544 (CHEMBL170873) Show SMILES Clc1ccc2C3C4CCC(N4)C3CCc2n1 |TLB:12:11:10:7.8,THB:4:5:10:7.8| Show InChI InChI=1S/C13H15ClN2/c14-12-6-2-8-10(16-12)3-1-7-9-4-5-11(15-9)13(7)8/h2,6-7,9,11,13,15H,1,3-5H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Tested for binding affinity against Nicotinic acetylcholine receptor alpha2-beta4				J Med Chem 46: 921-4 (2003) Article DOI: 10.1021/jm025613w BindingDB Entry DOI: 10.7270/Q2P271VS
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-4 (Rattus norvegicus (Rat))	BDBM50474544 (CHEMBL170873) Show SMILES Clc1ccc2C3C4CCC(N4)C3CCc2n1 |TLB:12:11:10:7.8,THB:4:5:10:7.8| Show InChI InChI=1S/C13H15ClN2/c14-12-6-2-8-10(16-12)3-1-7-9-4-5-11(15-9)13(7)8/h2,6-7,9,11,13,15H,1,3-5H2	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	41	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Tested for binding affinity against Nicotinic acetylcholine receptor alpha4-beta4				J Med Chem 46: 921-4 (2003) Article DOI: 10.1021/jm025613w BindingDB Entry DOI: 10.7270/Q2P271VS
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-2/beta-2 (Rattus norvegicus (Rat))	BDBM50474544 (CHEMBL170873) Show SMILES Clc1ccc2C3C4CCC(N4)C3CCc2n1 |TLB:12:11:10:7.8,THB:4:5:10:7.8| Show InChI InChI=1S/C13H15ClN2/c14-12-6-2-8-10(16-12)3-1-7-9-4-5-11(15-9)13(7)8/h2,6-7,9,11,13,15H,1,3-5H2	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	59	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Tested for binding affinity against Nicotinic acetylcholine receptor alpha2-beta2				J Med Chem 46: 921-4 (2003) Article DOI: 10.1021/jm025613w BindingDB Entry DOI: 10.7270/Q2P271VS
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-3/beta-4 (Rattus norvegicus (Rat))	BDBM50474544 (CHEMBL170873) Show SMILES Clc1ccc2C3C4CCC(N4)C3CCc2n1 |TLB:12:11:10:7.8,THB:4:5:10:7.8| Show InChI InChI=1S/C13H15ClN2/c14-12-6-2-8-10(16-12)3-1-7-9-4-5-11(15-9)13(7)8/h2,6-7,9,11,13,15H,1,3-5H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	201	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Tested for binding affinity against Nicotinic acetylcholine receptor alpha3-beta4				J Med Chem 46: 921-4 (2003) Article DOI: 10.1021/jm025613w BindingDB Entry DOI: 10.7270/Q2P271VS
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Rattus norvegicus (Rat))	BDBM50474544 (CHEMBL170873) Show SMILES Clc1ccc2C3C4CCC(N4)C3CCc2n1 |TLB:12:11:10:7.8,THB:4:5:10:7.8| Show InChI InChI=1S/C13H15ClN2/c14-12-6-2-8-10(16-12)3-1-7-9-4-5-11(15-9)13(7)8/h2,6-7,9,11,13,15H,1,3-5H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	295	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Tested for binding affinity against Nicotinic acetylcholine receptor alpha4-beta2				J Med Chem 46: 921-4 (2003) Article DOI: 10.1021/jm025613w BindingDB Entry DOI: 10.7270/Q2P271VS
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-3/beta-2 (Rattus norvegicus (Rat))	BDBM50474544 (CHEMBL170873) Show SMILES Clc1ccc2C3C4CCC(N4)C3CCc2n1 |TLB:12:11:10:7.8,THB:4:5:10:7.8| Show InChI InChI=1S/C13H15ClN2/c14-12-6-2-8-10(16-12)3-1-7-9-4-5-11(15-9)13(7)8/h2,6-7,9,11,13,15H,1,3-5H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	530	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Tested for binding affinity against Nicotinic acetylcholine receptor alpha3-beta2				J Med Chem 46: 921-4 (2003) Article DOI: 10.1021/jm025613w BindingDB Entry DOI: 10.7270/Q2P271VS
					More data for this Ligand-Target Pair