Reaction Details Report a problem with these data
Target
Dihydrofolate reductase
Ligand
BDBM50138691
Substrate
n/a
Meas. Tech.
ChEMBL_53943 (CHEMBL668662)
Ki
7079±n/a nM
Citation
 Li, RL; Dietrich, SW; Hansch, C Quantitative structure-selectivity relationships. Comparison of the inhibition of Escherichia coli and bovine liver dihydrofolate reductase by 5-(substituted-benzyl)-2,4-diaminopyrimidines. J Med Chem 24:538-44 (1981) [PubMed]  Article 
Target
Name:
Dihydrofolate reductase
Synonyms:
DHFR | DYR_BOVIN | Dihydrofolate reductase | Dihydrofolate reductase (DHFR)
Type:
Enzyme
Mol. Mass.:
21603.71
Organism:
Bos taurus (Cattle)
Description:
P00376
Residue:
187
Sequence:
MVRPLNCIVAVSQNMGIGKNGDLPWPPLRNEFQYFQRMTTVSSVEGKQNLVIMGRKTWFSIPEKNRPLKDRINIVLSRELKEPPKGAHFLAKSLDDALELIEDPELTNKVDVVWIVGGSSVYKEAMNKPGHVRLFVTRIMQEFESDAFFPEIDFEKYKLLPEYPGVPLDVQEEKGIKYKFEVYEKNN
  
Inhibitor
Name:
BDBM50138691
Synonyms:
5-(3,4-Dimethoxy-benzyl)-pyrimidine-2,4-diamine | CHEMBL19633 | Diaveridine
Type:
Small organic molecule
Emp. Form.:
C13H16N4O2
Mol. Mass.:
260.2917
SMILES:
COc1ccc(Cc2cnc(N)nc2N)cc1OC
Structure:
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