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Target
Leucine--tRNA ligase
Ligand
BDBM50286773
Substrate
n/a
Meas. Tech.
ChEMBL_1729565 (CHEMBL4144843)
IC50
1100±n/a nM
Citation
 Charlton, MH; Aleksis, R; Saint-Leger, A; Gupta, A; Loza, E; Ribas de Pouplana, L; Kaula, I; Gustina, D; Madre, M; Lola, D; Jaudzems, K; Edmund, G; Randall, CP; Kime, L; O'Neill, AJ; Goessens, W; Jirgensons, A; Finn, PW -Leucinyl Benzenesulfonamides as Structurally Simplified Leucyl-tRNA Synthetase Inhibitors. ACS Med Chem Lett 9:84-88 (2018) [PubMed]  Article 
Target
Name:
Leucine--tRNA ligase
Synonyms:
6.1.1.4 | Leucyl-tRNA synthetase, putative
Type:
PROTEIN
Mol. Mass.:
121824.94
Organism:
Trypanosoma brucei brucei (strain 927/4 GUTat10.1)
Description:
ChEMBL_117845
Residue:
1074
Sequence:
MSTVRRDRLVSIEAEAQARWSKEKIYELDAPLKGEETQPKFFTTFPYPYMNGRLHLGHTFSLTKCEFATRFWRMKGYRSLWPFGLHVTGTPIAACAQKIKLEMELYGNPPQFPAEVEDKPLEKKDEVATIGQHKGKRGKAGPAKPQWIIMRTMGIEESEIPKFADPLHWFDFFPPLAIQDLKRLGCHIDYRRSFITTDRNPYYDRFVSWQFRNLRSSNYLHYGKRYCIYSPLDKQPCADHDRASGEGALPQEYTVVKLKVKNPLEQPALAPFSEIIGNRSVILPGATLRPETVIGQTNCWVSPNFSYMAYSILNGTGEEEIYIMTSRAARNLAYQNFTVNGKTGVDPSPLFEVDGAKLIGLPLSAPLCPYDTIYTLPMQSIIETKGTGVVMSVPADSPDDYINYVQLVNKPDYRAKLGLKDEWVANKIVSLIEVPGEMGRESAKYMCEKLKINGPNATDLLEEAKKVIYQAGFYQGVMIAGPFAGEKVSAAKVKTVKLLEEQNAAIRYYEPARIVVSRSGEECVVALCDQWYIEYGKEEWKEMVMRHLKNMNLAPVVRNGFEETLNWLADWPCSRNFGLGTKFPSDEGGTMIIDSLSDSTIYMAYYTIAHFLHKGADGIHRLDAHHENALGVEPEMFTDETFDYIFRGRGTPESVHAVNGLPTEAAEKMRREFLYWYPVDLRCSGKDLIQNHLTMFLYNHAAIWPDDESKWPRSVFANGHVLVDNEKMSKSKGNFMTLEEAINEYGSDATRLACADAGDTLDDANFVRETATGFIMKLTTVIDGSEELLKNKRSLRGGEFNIFDRIFSNTINTIIIRVEKYYTNMQFRNVLNAAYHELSNEFSQYKLNCDTMQMHADLAERYLEVITLLLAPIAPHFSEYMWTTVLGRKTSVVLEPFPKVTAPVEYATLVASRVLTDVVKEIRAQVTKAQKKRGPITEVCVYTSGAYSEWQVKALGLLRELYEANNKSFPAEFSKAVMARRQDWMTKDILPDVMAFVSFTKMNVEQYGEEALASTPAINDMEVLKEVHASVCKLSGVPTVHILSNEDETYTEHRVARKKCRPGEPSVAFPDKKA
  
Inhibitor
Name:
BDBM50286773
Synonyms:
CHEMBL4174897
Type:
Small organic molecule
Emp. Form.:
C21H24BrClN4O5S2
Mol. Mass.:
591.926
SMILES:
CC(C)C[C@H](N)C(=O)NS(=O)(=O)c1cccc(NC(=S)NC(=O)COc2ccc(Br)cc2Cl)c1 |r|
Structure:
Search PDB for entries with ligand similarity: