BDBM50061955 (3-Benzyl-8-methyl-6-propyl-8-aza-bicyclo[3.2.1]oct-2-yl)-acetic acid methyl ester; hydrochloride::CHEMBL544145

SMILES: CCCC1CC2C(CC(=O)OC)C(Cc3ccccc3)CC1N2C

InChI Key: InChIKey=NYHLSJFRSGAHTE-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50061955   

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))	BDBM50061955 ((3-Benzyl-8-methyl-6-propyl-8-aza-bicyclo[3.2.1]oc...) Show SMILES CCCC1CC2C(CC(=O)OC)C(Cc3ccccc3)CC1N2C |TLB:23:22:6.12.20:4.3,THB:7:6:22:4.3,13:12:22:4.3,2:3:22:6.12.20| Show InChI InChI=1S/C21H31NO2/c1-4-8-16-12-20-18(14-21(23)24-3)17(13-19(16)22(20)2)11-15-9-6-5-7-10-15/h5-7,9-10,16-20H,4,8,11-14H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.85E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of New Orleans Curated by ChEMBL					Assay Description Displacement of [3H]WIN-35428 from dopamine transporter in rat caudate putamen tissue				J Med Chem 40: 4406-14 (1998) Article DOI: 10.1021/jm970549h BindingDB Entry DOI: 10.7270/Q22R3SBZ
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50061955 ((3-Benzyl-8-methyl-6-propyl-8-aza-bicyclo[3.2.1]oc...) Show SMILES CCCC1CC2C(CC(=O)OC)C(Cc3ccccc3)CC1N2C |TLB:23:22:6.12.20:4.3,THB:7:6:22:4.3,13:12:22:4.3,2:3:22:6.12.20| Show InChI InChI=1S/C21H31NO2/c1-4-8-16-12-20-18(14-21(23)24-3)17(13-19(16)22(20)2)11-15-9-6-5-7-10-15/h5-7,9-10,16-20H,4,8,11-14H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.73E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of New Orleans Curated by ChEMBL					Assay Description Displacement of [3H]WIN-35428 from dopamine transporter in rat caudate putamen tissue				J Med Chem 40: 4406-14 (1998) Article DOI: 10.1021/jm970549h BindingDB Entry DOI: 10.7270/Q22R3SBZ
					More data for this Ligand-Target Pair