Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM159344'   

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 (Homo sapiens (Human))	BDBM159344 (US9034899, 35 | US9604960, 35) Show SMILES CC1(C)NCC(c2ccc(Cl)cc2)c2ccc(cc12)-c1cnc(cn1)C(F)(F)F Show InChI InChI=1S/C22H19ClF3N3/c1-21(2)18-9-14(19-11-28-20(12-27-19)22(24,25)26)5-8-16(18)17(10-29-21)13-3-6-15(23)7-4-13/h3-9,11-12,17,29H,10H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
Albany Molecular Research, Inc. US Patent					Assay Description Compounds were dissolved in 100% DMSO at a concentration 100 times the desired highest assay concentration, serially diluted 1:3 in 100% DMSO, and 0....				US Patent US9604960 (2017) BindingDB Entry DOI: 10.7270/Q2QC05KM
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM159344 (US9034899, 35 | US9604960, 35) Show SMILES CC1(C)NCC(c2ccc(Cl)cc2)c2ccc(cc12)-c1cnc(cn1)C(F)(F)F Show InChI InChI=1S/C22H19ClF3N3/c1-21(2)18-9-14(19-11-28-20(12-27-19)22(24,25)26)5-8-16(18)17(10-29-21)13-3-6-15(23)7-4-13/h3-9,11-12,17,29H,10H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	61.1	n/a	n/a	n/a	n/a	7.5	4
Albany Molecular Research, Inc. US Patent					Assay Description Compounds were dissolved in 100% DMSO at a concentration 100 times the desired highest assay concentration, serially diluted 1:3 in 100% DMSO, and 0....				US Patent US9034899 (2015) BindingDB Entry DOI: 10.7270/Q20000VT
					More data for this Ligand-Target Pair