Reaction Details  Report a problem with these data
Target
Dihydrofolate reductase
Ligand
BDBM50058396
Substrate
n/a
Meas. Tech.
ChEMBL_54960 (CHEMBL669620)
IC50
890±n/a nM
Citation
 Stevens, MF; Phillip, KS; Rathbone, DL; O'Shea, DM; Queener, SF; Schwalbe, CH; Lambert, PA Structural studies on bioactive compounds. 28. Selective activity of triazenyl-substituted pyrimethamine derivatives against Pneumocystis carinii dihydrofolate reductase. J Med Chem 40:1886-93 (1997) [PubMed]  Article
Target
Name:
Dihydrofolate reductase
Synonyms:
DYR_RAT | Dhfr | Dihydrofolate reductase (DHFR) | Dihydrofolate reductase; P. carinii vs rat | Tetrahydrofolate dehydrogenase
Type:
Enzyme
Mol. Mass.:
21638.84
Organism:
Rattus norvegicus (rat)
Description:
n/a
Residue:
187
Sequence:
MVRPLNCIVAVSQNMGIGKNGDLPWPLLRNEFKYFQRMTTTSSVEGKQNLVIMGRKTWFSIPEKNRPLKDRINIVLSRELKEPPQGAHFLAKSLDDALKLIEQPELASKVDMVWVVGGSSVYQEAMNQPGHLRLFVTRIMQEFESDTFFPEIDLEKYKLLPEYPGVLSEIQEEKGIKYKFEVYEKKD
  
Inhibitor
Name:
BDBM50058396
Synonyms:
5-{4-chloro-3-[(1E)-3-methyl-3-propyltriaz-1-enyl]phenyl}-6-ethylpyrimidine-2,4-diamine | CHEMBL293822 | CHEMBL294468
Type:
Small organic molecule
Emp. Form.:
C16H22ClN7
Mol. Mass.:
347.846
SMILES:
CCCN(C)\N=N\c1cc(ccc1Cl)-c1c(N)nc(N)nc1CC
Structure:
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