Reaction Details Report a problem with these data
Target
Dihydrofolate reductase
Ligand
BDBM50049608
Substrate
n/a
Meas. Tech.
ChEMBL_55116 (CHEMBL884367)
IC50
82±n/a nM
Citation
 Gangjee, A; Zhu, Y; Queener, SF; Francom, P; Broom, AD Nonclassical 2,4-diamino-8-deazafolate analogues as inhibitors of dihydrofolate reductases from rat liver, Pneumocystis carinii, and Toxoplasma gondii. J Med Chem 39:1836-45 (1996) [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:
BDBM50049608
Synonyms:
6-[(2,6-Dichloro-phenylamino)-methyl]-pyrido[3,2-d]pyrimidine-2,4-diamine | CHEMBL54913
Type:
Small organic molecule
Emp. Form.:
C14H12Cl2N6
Mol. Mass.:
335.191
SMILES:
Nc1nc(N)c2nc(CNc3c(Cl)cccc3Cl)ccc2n1
Structure:
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