Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50272728'   

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))	BDBM50272728 (((3S,4S)-4-(2-fluoro-6-methylphenoxy)-3,4-dihydro-...) Show SMILES CNC[C@@H]1OCc2ccccc2[C@@H]1Oc1c(C)cccc1F |r| Show InChI InChI=1S/C18H20FNO2/c1-12-6-5-9-15(19)17(12)22-18-14-8-4-3-7-13(14)11-21-16(18)10-20-2/h3-9,16,18,20H,10-11H2,1-2H3/t16-,18-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Inhibition of serotonin uptake at human SERT expressed in HEK293 cells				Bioorg Med Chem Lett 18: 4491-4 (2008) Article DOI: 10.1016/j.bmcl.2008.07.049 BindingDB Entry DOI: 10.7270/Q2S75H8V
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50272728 (((3S,4S)-4-(2-fluoro-6-methylphenoxy)-3,4-dihydro-...) Show SMILES CNC[C@@H]1OCc2ccccc2[C@@H]1Oc1c(C)cccc1F |r| Show InChI InChI=1S/C18H20FNO2/c1-12-6-5-9-15(19)17(12)22-18-14-8-4-3-7-13(14)11-21-16(18)10-20-2/h3-9,16,18,20H,10-11H2,1-2H3/t16-,18-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Inhibition of serotonin uptake at human SERT expressed in HEK cells				Bioorg Med Chem Lett 18: 4495-8 (2008) Article DOI: 10.1016/j.bmcl.2008.07.050 BindingDB Entry DOI: 10.7270/Q2VH5NP8
					More data for this Ligand-Target Pair