Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM22198'   

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))	BDBM22198 (1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(2-pheny...) Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CCc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C27H30F2N2O/c28-25-10-6-23(7-11-25)27(24-8-12-26(29)13-9-24)32-21-20-31-18-16-30(17-19-31)15-14-22-4-2-1-3-5-22/h1-13,27H,14-21H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	36	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Binding affinity for serotonin transporter				J Med Chem 45: 1321-9 (2002) BindingDB Entry DOI: 10.7270/Q2K073KD
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM22198 (1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(2-pheny...) Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CCc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C27H30F2N2O/c28-25-10-6-23(7-11-25)27(24-8-12-26(29)13-9-24)32-21-20-31-18-16-30(17-19-31)15-14-22-4-2-1-3-5-22/h1-13,27H,14-21H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	36	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University					Assay Description The assay was initiated by the addition of membranes to binding buffer containing test compound, blocker, and radioligand. The samples were incubated...				J Med Chem 51: 2795-806 (2008) Article DOI: 10.1021/jm701270n BindingDB Entry DOI: 10.7270/Q2B27SK6
					More data for this Ligand-Target Pair