BDBM50099223 1-[3-(7-Iodo-naphthalen-2-yl)-8-methyl-8-aza-bicyclo[3.2.1]oct-2-yl]-propan-1-one::CHEMBL435371

SMILES: CCC(=O)C1C2CCC(CC1c1ccc3ccc(I)cc3c1)N2C

InChI Key: InChIKey=XESVDTJFBSOHPO-UHFFFAOYSA-N

Data: 1 KI  1 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 2 hits for monomerid = 50099223   

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 serotonin transporter (Rattus norvegicus (rat))	BDBM50099223 (1-[3-(7-Iodo-naphthalen-2-yl)-8-methyl-8-aza-bicyc...) Show SMILES CCC(=O)C1C2CCC(CC1c1ccc3ccc(I)cc3c1)N2C |TLB:23:22:4.10.9:6.7,THB:11:10:22:6.7,2:4:22:6.7| Show InChI InChI=1S/C21H24INO/c1-3-20(24)21-18(12-17-8-9-19(21)23(17)2)14-5-4-13-6-7-16(22)11-15(13)10-14/h4-7,10-11,17-19,21H,3,8-9,12H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.470	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
State University of New York Curated by ChEMBL					Assay Description Affinity for the displacement of [3H]-paroxetine binding to serotonin transporter (SERT) in rat frontal cortex membranes				J Med Chem 44: 1509-15 (2001) BindingDB Entry DOI: 10.7270/Q2H1318R
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50099223 (1-[3-(7-Iodo-naphthalen-2-yl)-8-methyl-8-aza-bicyc...) Show SMILES CCC(=O)C1C2CCC(CC1c1ccc3ccc(I)cc3c1)N2C |TLB:23:22:4.10.9:6.7,THB:11:10:22:6.7,2:4:22:6.7| Show InChI InChI=1S/C21H24INO/c1-3-20(24)21-18(12-17-8-9-19(21)23(17)2)14-5-4-13-6-7-16(22)11-15(13)10-14/h4-7,10-11,17-19,21H,3,8-9,12H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.450	n/a	n/a	n/a	n/a	n/a	n/a
State University of New York Curated by ChEMBL					Assay Description Inhibitory activity in displacing [125I]- RTI-55 binding to dopamine transporter in rat striatal membranes				J Med Chem 44: 1509-15 (2001) BindingDB Entry DOI: 10.7270/Q2H1318R
					More data for this Ligand-Target Pair