Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50023174'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM50023174 (CHEMBL3298867) Show SMILES Cl.COc1cccc(c1)C(=O)C(C)NC1CC1 Show InChI InChI=1S/C13H17NO2.ClH/c1-9(14-11-6-7-11)13(15)10-4-3-5-12(8-10)16-2;/h3-5,8-9,11,14H,6-7H2,1-2H3;1H	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	1.01E+3	n/a	n/a	n/a	n/a
RTI International Curated by ChEMBL					Assay Description Induction of SERT-mediated serotonin release in rat synaptosomes				ACS Med Chem Lett 5: 623-7 (2014) Article DOI: 10.1021/ml500113s BindingDB Entry DOI: 10.7270/Q2FN17SS
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