Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM159331'   

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))	BDBM159331 (US9034899, 13 | US9604960, 13) Show SMILES CC1(C)NCC(c2ccc(Cl)c(Cl)c2)c2ccc(cc12)-c1ccc(N)nn1 Show InChI InChI=1S/C21H20Cl2N4/c1-21(2)16-9-13(19-7-8-20(24)27-26-19)3-5-14(16)15(11-25-21)12-4-6-17(22)18(23)10-12/h3-10,15,25H,11H2,1-2H3,(H2,24,27)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.30	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))	BDBM159331 (US9034899, 13 | US9604960, 13) Show SMILES CC1(C)NCC(c2ccc(Cl)c(Cl)c2)c2ccc(cc12)-c1ccc(N)nn1 Show InChI InChI=1S/C21H20Cl2N4/c1-21(2)16-9-13(19-7-8-20(24)27-26-19)3-5-14(16)15(11-25-21)12-4-6-17(22)18(23)10-12/h3-10,15,25H,11H2,1-2H3,(H2,24,27)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.30	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