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Target
Dihydrofolate reductase
Ligand
BDBM50449543
Substrate
n/a
Meas. Tech.
ChEMBL_1740105 (CHEMBL4155855)
Ki
1400±n/a nM
Citation
 Francesconi, V; Giovannini, L; Santucci, M; Cichero, E; Costi, MP; Naesens, L; Giordanetto, F; Tonelli, M Synthesis, biological evaluation and molecular modeling of novel azaspiro dihydrotriazines as influenza virus inhibitors targeting the host factor dihydrofolate reductase (DHFR). Eur J Med Chem 155:229-243 (2018) [PubMed]  Article 
Target
Name:
Dihydrofolate reductase
Synonyms:
DHFR | DYR_HUMAN | Dihydrofolate reductase (DHFR) | Tetrahydrofolate dehydrogenase
Type:
Enzyme
Mol. Mass.:
21453.99
Organism:
Homo sapiens (Human)
Description:
Recombinant human DHFR.
Residue:
187
Sequence:
MVGSLNCIVAVSQNMGIGKNGDLPWPPLRNEFRYFQRMTTTSSVEGKQNLVIMGKKTWFSIPEKNRPLKGRINLVLSRELKEPPQGAHFLSRSLDDALKLTEQPELANKVDMVWIVGGSSVYKEAMNHPGHLKLFVTRIMQDFESDTFFPEIDLEKYKLLPEYPGVLSDVQEEKGIKYKFEVYEKND
  
Inhibitor
Name:
BDBM50449543
Synonyms:
CHEMBL4169854
Type:
Small organic molecule
Emp. Form.:
C12H24N6O3S
Mol. Mass.:
332.422
SMILES:
CCS(=O)(=O)N1CCC2(CC1)N=C(N)N=C(N)N2CCOC |t:12,15|
Structure:
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