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Target
Dihydrofolate reductase
Ligand
BDBM50120976
Substrate
n/a
Meas. Tech.
ChEMBL_54739 (CHEMBL667190)
IC50
3000±n/a nM
Citation
 Gangjee, A; Zeng, Y; McGuire, JJ; Kisliuk, RL Synthesis of classical and nonclassical, partially restricted, linear, tricyclic 5-deaza antifolates. J Med Chem 45:5173-81 (2002) [PubMed]  Article 
Target
Name:
Dihydrofolate reductase
Synonyms:
Dihydrofolate reductase (F31V) | dfrA17
Type:
n/a
Mol. Mass.:
17532.46
Organism:
Escherichia coli
Description:
n/a
Residue:
157
Sequence:
MKISLISAVSESGVIGSGPDIPWSVKGEQLLFKALTYNQWLLVGRKTFDSMGVLPNRKYAVVSKNGISSSNENVLVFPSIENALKELSKVTDHVYVSGGGQIYNSLIEKADIIHLSTVHVEVEGDIKFPIMPENFNLVFEQFFMSNINYTYQIWKKG
  
Inhibitor
Name:
BDBM50120976
Synonyms:
6-(3,5-Dimethoxy-benzyl)-5,6,7,8-tetrahydro-1,3,6,9-tetraaza-anthracene-2,4-diamine | CHEMBL357973
Type:
Small organic molecule
Emp. Form.:
C19H22N6O2
Mol. Mass.:
366.417
SMILES:
COc1cc(CN2CCc3nc4nc(N)nc(N)c4cc3C2)cc(OC)c1
Structure:
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