BDBM50068470 (2S,8S)-2-Butyl-8-methyl-3-p-tolyl-8-aza-bicyclo[3.2.1]octane

SMILES: CCCC[C@@H]1C2CCC(CC1c1ccc(C)cc1)N2C

InChI Key: InChIKey=BGNPBRDPWFXAKX-JRVPFXOQSA-N

Data: 3 KI  3 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 6 hits for monomerid = 50068470   

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
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50068470 ((2S,8S)-2-Butyl-8-methyl-3-p-tolyl-8-aza-bicyclo[3...) Show SMILES CCCC[C@@H]1C2CCC(CC1c1ccc(C)cc1)N2C |TLB:19:18:10.4.9:6.7,THB:11:10:18:6.7,3:4:18:6.7| Show InChI InChI=1S/C19H29N/c1-4-5-6-17-18(15-9-7-14(2)8-10-15)13-16-11-12-19(17)20(16)3/h7-10,16-19H,4-6,11-13H2,1-3H3/t16?,17-,18?,19?/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.30	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 Binding affinity for [3H]DA (Dopamine transporter) uptake by striated synaptosomes				J Med Chem 41: 4973-82 (1999) Article DOI: 10.1021/jm9802564 BindingDB Entry DOI: 10.7270/Q29S1RQ7
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50068470 ((2S,8S)-2-Butyl-8-methyl-3-p-tolyl-8-aza-bicyclo[3...) Show SMILES CCCC[C@@H]1C2CCC(CC1c1ccc(C)cc1)N2C |TLB:19:18:10.4.9:6.7,THB:11:10:18:6.7,3:4:18:6.7| Show InChI InChI=1S/C19H29N/c1-4-5-6-17-18(15-9-7-14(2)8-10-15)13-16-11-12-19(17)20(16)3/h7-10,16-19H,4-6,11-13H2,1-3H3/t16?,17-,18?,19?/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.80	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 Binding affinity of compound on dopamine transporters of rat striated membranes using [3H]- mazindol.				J Med Chem 41: 4973-82 (1999) Article DOI: 10.1021/jm9802564 BindingDB Entry DOI: 10.7270/Q29S1RQ7
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50068470 ((2S,8S)-2-Butyl-8-methyl-3-p-tolyl-8-aza-bicyclo[3...) Show SMILES CCCC[C@@H]1C2CCC(CC1c1ccc(C)cc1)N2C |TLB:19:18:10.4.9:6.7,THB:11:10:18:6.7,3:4:18:6.7| Show InChI InChI=1S/C19H29N/c1-4-5-6-17-18(15-9-7-14(2)8-10-15)13-16-11-12-19(17)20(16)3/h7-10,16-19H,4-6,11-13H2,1-3H3/t16?,17-,18?,19?/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	15	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 Binding affinity for Serotonin transporter was determined by [3H]5-HT (serotonin) uptake by striated synaptosomes				J Med Chem 41: 4973-82 (1999) Article DOI: 10.1021/jm9802564 BindingDB Entry DOI: 10.7270/Q29S1RQ7
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50068470 ((2S,8S)-2-Butyl-8-methyl-3-p-tolyl-8-aza-bicyclo[3...) Show SMILES CCCC[C@@H]1C2CCC(CC1c1ccc(C)cc1)N2C |TLB:19:18:10.4.9:6.7,THB:11:10:18:6.7,3:4:18:6.7| Show InChI InChI=1S/C19H29N/c1-4-5-6-17-18(15-9-7-14(2)8-10-15)13-16-11-12-19(17)20(16)3/h7-10,16-19H,4-6,11-13H2,1-3H3/t16?,17-,18?,19?/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibitory activity determined for [3H]DA (Dopamine transporter) uptake by striated synaptosomes				J Med Chem 41: 4973-82 (1999) Article DOI: 10.1021/jm9802564 BindingDB Entry DOI: 10.7270/Q29S1RQ7
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50068470 ((2S,8S)-2-Butyl-8-methyl-3-p-tolyl-8-aza-bicyclo[3...) Show SMILES CCCC[C@@H]1C2CCC(CC1c1ccc(C)cc1)N2C |TLB:19:18:10.4.9:6.7,THB:11:10:18:6.7,3:4:18:6.7| Show InChI InChI=1S/C19H29N/c1-4-5-6-17-18(15-9-7-14(2)8-10-15)13-16-11-12-19(17)20(16)3/h7-10,16-19H,4-6,11-13H2,1-3H3/t16?,17-,18?,19?/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibitory activity against Serotonin transporter was determined for [3H]5-HT (serotonin) uptake by striated synaptosomes				J Med Chem 41: 4973-82 (1999) Article DOI: 10.1021/jm9802564 BindingDB Entry DOI: 10.7270/Q29S1RQ7
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50068470 ((2S,8S)-2-Butyl-8-methyl-3-p-tolyl-8-aza-bicyclo[3...) Show SMILES CCCC[C@@H]1C2CCC(CC1c1ccc(C)cc1)N2C |TLB:19:18:10.4.9:6.7,THB:11:10:18:6.7,3:4:18:6.7| Show InChI InChI=1S/C19H29N/c1-4-5-6-17-18(15-9-7-14(2)8-10-15)13-16-11-12-19(17)20(16)3/h7-10,16-19H,4-6,11-13H2,1-3H3/t16?,17-,18?,19?/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibitory activity on dopamine transporters of rat striated membranes using [3H]- mazindol.				J Med Chem 41: 4973-82 (1999) Article DOI: 10.1021/jm9802564 BindingDB Entry DOI: 10.7270/Q29S1RQ7
					More data for this Ligand-Target Pair