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Target
Dihydrofolate reductase
Ligand
BDBM50310332
Substrate
n/a
Meas. Tech.
ChEMBL_608248 (CHEMBL1072437)
IC50
16300±n/a nM
Citation
 Gangjee, A; Jain, HD; Phan, J; Guo, X; Queener, SF; Kisliuk, RL 2,4-Diamino-5-methyl-6-substituted arylthio-furo[2,3-d]pyrimidines as novel classical and nonclassical antifolates as potential dual thymidylate synthase and dihydrofolate reductase inhibitors. Bioorg Med Chem 18:953-61 (2010) [PubMed]  Article 
Target
Name:
Dihydrofolate reductase
Synonyms:
Dihydrofolate reductase (DHFR) | Tetrahydrofolate dehydrogenase
Type:
Enzyme
Mol. Mass.:
19884.75
Organism:
Mycobacterium avium
Description:
Recombinant Mycobacterium avium DHFR expressed in E. coli.
Residue:
181
Sequence:
MTRAEVGLVWAQSTSGVIGRGGDIPWSVPEDLTRFKEVTMGHTVIMGRRTWESLPAKVRPLPGRRNVVVSRRPDFVAEGARVAGSLEAALAYAGSDPAPWVIGGAQIYLLALPHATRCEVTEIEIDLRRDDDDALAPALDDSWVGETGEWLASRSGLRYRFHSYRRDPRSSVRGCSPSRPS
  
Inhibitor
Name:
BDBM50310332
Synonyms:
2,4-Diamino-5-methyl-6-(3',4'-dimethoxyphenylsulfanyl)-furo[2,3-d]pyrimidine | CHEMBL598293
Type:
Small organic molecule
Emp. Form.:
C15H16N4O3S
Mol. Mass.:
332.378
SMILES:
COc1ccc(Sc2oc3nc(N)nc(N)c3c2C)cc1OC
Structure:
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