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Target
Dihydrofolate reductase
Ligand
BDBM50130950
Substrate
n/a
Meas. Tech.
ChEMBL_1458972 (CHEMBL3369565)
Kd
120±n/a nM
Citation
 Gibbs, AC Elements and modulation of functional dynamics. J Med Chem 57:7819-37 (2014) [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:
BDBM50130950
Synonyms:
5-(4-Chloro-phenylsulfanyl)-quinazoline-2,4-diamine | 5-[(4-chlorophenyl)sulfanyl]quinazoline-2,4-diamine | 5-[(4-chlorophenyl)sulfanyl]quinazoline-2,4-diamine, 2d | CHEMBL310759
Type:
Small organic molecule
Emp. Form.:
C14H11ClN4S
Mol. Mass.:
302.782
SMILES:
Nc1nc(N)c2c(Sc3ccc(Cl)cc3)cccc2n1
Structure:
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