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Target
Dihydrofolate reductase type 1
Ligand
BDBM50291779
Substrate
n/a
Meas. Tech.
ChEMBL_54572 (CHEMBL664886)
Ki
3090±n/a nM
Citation
 Coats, EA; Genther, CS; Selassie, CD; Strong, CD; Hansch, C Quantitative structure-activity relationship of antifolate inhibition of bacteria cell cultures resistant and sensitive to methotrexate. J Med Chem 28:1910-6 (1985) [PubMed]  Article 
Target
Name:
Dihydrofolate reductase type 1
Synonyms:
DYR1_ECOLX | dhfrI
Type:
PROTEIN
Mol. Mass.:
17574.87
Organism:
Escherichia coli
Description:
ChEMBL_54248
Residue:
157
Sequence:
MKLSLMVAISKNGVIGNGPDIPWSAKGEQLLFKAITYNQWLLVGRKTFESMGALPNRKYAVVTRSSFTSDNENVLIFPSIKDALTNLKKITDHVIVSGGGEIYKSLIDQVDTLHISTIDIEPEGDVYFPEIPSNFRPVFTQDFASNINYSYQIWQKG
  
Inhibitor
Name:
BDBM50291779
Synonyms:
3-(4,6-Diamino-2,2-dimethyl-2H-[1,3,5]triazin-1-yl)-benzonitrile | CHEMBL268914
Type:
Small organic molecule
Emp. Form.:
C12H14N6
Mol. Mass.:
242.2798
SMILES:
CC1(C)N=C(N)N=C(N)N1c1cccc(c1)C#N |t:3,6|
Structure:
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