Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent proline transporter' and Ligand = 'BDBM50052698'   

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 proline transporter (Homo sapiens (Human))	BDBM50052698 (CHEMBL3318547) Show SMILES FC(F)(F)c1ccccc1-c1ccc(cc1)C(=O)N1CCN(CC1)c1ncccn1 Show InChI InChI=1S/C22H19F3N4O/c23-22(24,25)19-5-2-1-4-18(19)16-6-8-17(9-7-16)20(30)28-12-14-29(15-13-28)21-26-10-3-11-27-21/h1-11H,12-15H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lexicon Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of human high-affinity L-proline transporter expressed in COS1 cells by [3H]proline uptake assay				Bioorg Med Chem Lett 24: 3886-90 (2014) Article DOI: 10.1016/j.bmcl.2014.06.049 BindingDB Entry DOI: 10.7270/Q20C4XDG
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