Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Excitatory amino acid transporter 3' and Ligand = 'BDBM50401544'   

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
Excitatory amino acid transporter 3 (Homo sapiens (Human))	BDBM50401544 (CHEMBL2207077) Show SMILES CCN(CC)c1ccc2c(cc(=O)oc2c1)C1C(C#N)C(=N)OC2=C1C(=O)CC(C2)c1cccc2ccccc12 |c:25| Show InChI InChI=1S/C33H29N3O4/c1-3-36(4-2)21-12-13-24-25(17-30(38)39-28(24)16-21)31-26(18-34)33(35)40-29-15-20(14-27(37)32(29)31)23-11-7-9-19-8-5-6-10-22(19)23/h5-13,16-17,20,26,31,35H,3-4,14-15H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Inhibition of [3H]-D-aspartate uptake at human EAAT3 expressed in HEK293 cells after 6 mins by scintillation counting				Bioorg Med Chem 20: 6831-9 (2012) Article DOI: 10.1016/j.bmc.2012.09.049 BindingDB Entry DOI: 10.7270/Q25B03PT
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