Reaction Details Report a problem with these data
Target
Methionine--tRNA ligase
Ligand
BDBM57358
Substrate
n/a
IC50
1636±n/a nM
Citation
 PubChem, PC Luminescence-based biochemical high throughput dose response assay for inhibitors of Trypanosoma brucei methionyl tRNA synthetase (MetRS) PubChem Bioassay (2013)[AID] 
Target
Name:
Methionine--tRNA ligase
Synonyms:
methionyl-tRNA synthetase
Type:
Enzyme Catalytic Domain
Mol. Mass.:
86905.45
Organism:
Trypanosoma brucei brucei strain 927/4 GUTat10.1
Description:
gi_71746704
Residue:
773
Sequence:
MALKLLSEKANSQALKVLLCSYYVKRPVEVSLSGAYATPILHHPAFKQPIIAPNEMARVILFYSVEPTSNNGGAADSSNGDGTASPVAGLTNLTLEHETWLEWEATTFTRAVHPLYTQRRQTAESLAVFSYLDKKISENDDRCVYSPAVEGKGAADPTDAVSTFFIDCIVWCAVLPALCESGVLRDSEKQQLPHLVKWFNTFQKEQKTLIDNAFENLSVQEAADFLRCPRVYKVSAKVEKVFFVTSPIYYVNAAPHIGHVYSTLITDVIGRYHRVKGERVFALTGTDEHGQKVAEAAKQKQVSPYDFTAAVAGEFKKCFEQMDYSIDYFIRTTNEQHKAVVKELWTKLEQKGDIYLGRYEGWYSISDESFLTPQNITDGVDKDGNPCKVSLESGHVVTWVSEENYMFRLSAFRERLLEWYHANPGCIVPEFRRREVIRAVEKGLPDLSVSRKKETLHNWAIPVPGNPDHCVYVWLDALTNYLTGSRLRVDESGKEVSLADDFSELERFPADVHVIGKDILKFHAIYWPAFLLSAGLPLPKKIVAHGWWTKDRKKISKSLGNVFDPVEKAEEFGYDALKYFLLRESGFSDDGDYSDKNMIARLNGELADTLGNLVMRCTSAKINVNGEWPSPAAYTEEDESLIQLIKDLPGTADHYYLIPDIQKAIIAVFDVLRAINAYVTDMAPWKLVKTDPERLRTVLYITLEGVRVTTLLLSPILPRKSVVIFDMLGVPEVHRKGIENFEFGAVPPGTRLGPAVEGEVLFSKRSTENTKST
  
Inhibitor
Name:
BDBM57358
Synonyms:
1-[[2-(3,4-dichlorophenyl)quinolin-4-yl]carbonylamino]-3-phenyl-urea | 1-[[2-(3,4-dichlorophenyl)quinoline-4-carbonyl]amino]-3-phenyl-urea | 1-[[2-(3,4-dichlorophenyl)quinoline-4-carbonyl]amino]-3-phenylurea | 1-[[[2-(3,4-dichlorophenyl)-4-quinolinyl]-oxomethyl]amino]-3-phenylurea | 2-{[2-(3,4-dichlorophenyl)-4-quinolinyl]carbonyl}-N-phenylhydrazinecarboxamide | MLS000545716 | SMR000159529 | cid_1012180
Type:
Small organic molecule
Emp. Form.:
C23H16Cl2N4O2
Mol. Mass.:
451.305
SMILES:
Clc1ccc(cc1Cl)-c1cc(C(=O)NNC(=O)Nc2ccccc2)c2ccccc2n1
Structure:
Search PDB for entries with ligand similarity: