BDBM50263915 1-(4-(3-chloro-4-(methylthio)phenoxy)pyridin-3-yl)-N,N-dimethylmethanamine::CHEMBL491393

SMILES: CSc1ccc(Oc2ccncc2CN(C)C)cc1Cl

InChI Key: InChIKey=AATCVLWFSZDJGG-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 50263915   

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 (Homo sapiens (Human))	BDBM50263915 (1-(4-(3-chloro-4-(methylthio)phenoxy)pyridin-3-yl)...) Show SMILES CSc1ccc(Oc2ccncc2CN(C)C)cc1Cl Show InChI InChI=1S/C15H17ClN2OS/c1-18(2)10-11-9-17-7-6-14(11)19-12-4-5-15(20-3)13(16)8-12/h4-9H,10H2,1-3H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of [3H]5HT reuptake at human serotonin transporter expressed in HEK293 cells				Bioorg Med Chem Lett 18: 5303-6 (2008) Article DOI: 10.1016/j.bmcl.2008.08.040 BindingDB Entry DOI: 10.7270/Q20K28DX
					More data for this Ligand-Target Pair