Reaction Details Report a problem with these data
Target
Dihydrofolate reductase
Ligand
BDBM50058399
Substrate
n/a
Meas. Tech.
ChEMBL_54960 (CHEMBL669620)
IC50
1100±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:
BDBM50058399
Synonyms:
5-[4-Chloro-3-(morpholin-4-ylazo)-phenyl]-6-ethyl-pyrimidine-2,4-diamine | CHEMBL293265 | CHEMBL48203
Type:
Small organic molecule
Emp. Form.:
C16H20ClN7O
Mol. Mass.:
361.829
SMILES:
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(c1)\N=N\N1CCOCC1
Structure:
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