BDBM50353005 CHEMBL1231666
SMILES: FC(F)(F)c1ccccc1S(=O)(=O)NNC(=O)c1cc2cc(Cl)ccc2o1
InChI Key: InChIKey=ZLQBZYKAQQWOTK-UHFFFAOYSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
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Branched-chain-amino-acid transferase (Homo sapiens (Human)) | BDBM50353005![]() (CHEMBL1231666) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar | Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars | MMDB PDB Article PubMed | n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories Curated by ChEMBL | Assay Description Inhibition of human recombinant histidine-tagged BCATc expressed in Escherichia coli BL21 (DE3) after 50 mins using [13C]-L-leucine as substrate by N... | Bioorg Med Chem Lett 21: 5248-50 (2011) Article DOI: 10.1016/j.bmcl.2011.07.039 BindingDB Entry DOI: 10.7270/Q2CR5TR9 | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (crystal) |