Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50118262'   

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))	BDBM50118262 (9-(4-Methoxy-phenyl)-1,2,3,9-tetrahydro-4,9a-diaza...) Show SMILES COc1ccc(cc1)C1(O)N2CCCN=C2c2ccccc12 |c:15| Show InChI InChI=1S/C18H18N2O2/c1-22-14-9-7-13(8-10-14)18(21)16-6-3-2-5-15(16)17-19-11-4-12-20(17)18/h2-3,5-10,21H,4,11-12H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	55.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Drew University Curated by ChEMBL					Assay Description Displacement of [125I]- RTI-55 from Serotonin transporter expressed in HEK cells				J Med Chem 45: 4097-109 (2002) BindingDB Entry DOI: 10.7270/Q2MC90R8
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50118262 (9-(4-Methoxy-phenyl)-1,2,3,9-tetrahydro-4,9a-diaza...) Show SMILES COc1ccc(cc1)C1(O)N2CCCN=C2c2ccccc12 |c:15| Show InChI InChI=1S/C18H18N2O2/c1-22-14-9-7-13(8-10-14)18(21)16-6-3-2-5-15(16)17-19-11-4-12-20(17)18/h2-3,5-10,21H,4,11-12H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	94	n/a	n/a	n/a	n/a	n/a	n/a
Drew University Curated by ChEMBL					Assay Description Inhibition of 5-HT uptake in HEK cells expressing human serotonin transporter (hSERT)				J Med Chem 45: 4097-109 (2002) BindingDB Entry DOI: 10.7270/Q2MC90R8
					More data for this Ligand-Target Pair