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Target
Dihydrofolate reductase
Ligand
BDBM50028549
Substrate
n/a
Meas. Tech.
ChEMBL_52868 (CHEMBL666227)
Ki
9±n/a nM
Citation
 Cody, V; Zakrzewski, SF Molecular structures of 2,4-diaminopyrimidine antifolates with antineoplastic activity. J Med Chem 25:427-30 (1982) [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:
BDBM50028549
Synonyms:
Adamantane-1-carboxylic acid (2,4-diamino-6-methyl-pyrimidin-5-yl)-amide; ethane sulfonate
Type:
Small organic molecule
Emp. Form.:
C16H23N5O
Mol. Mass.:
301.3867
SMILES:
Cc1nc(N)nc(N)c1NC(=O)C12CC3CC(CC(C3)C1)C2 |TLB:15:16:20:13.14.19,19:14:21:20.18.17,19:18:21:13.14.15,THB:15:14:20:21.16.17|
Structure:
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