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Target
Dihydrofolate reductase
Ligand
BDBM50010925
Substrate
n/a
Meas. Tech.
ChEBML_53962
IC50
88±n/a nM
Citation
 Rosowsky, A; Bader, H; Freisheim, JH Analogues of methotrexate and aminopterin with gamma-methylene and gamma-cyano substitution of the glutamate side chain: synthesis and in vitro biological activity. J Med Chem 34:203-8 (1991) [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:
BDBM50010925
Synonyms:
2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-amino]-benzoylamino}-4-methylene-pentanedioic acid | CHEMBL65711
Type:
Small organic molecule
Emp. Form.:
C20H20N8O5
Mol. Mass.:
452.4234
SMILES:
Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)NC(CC(=C)C(O)=O)C(O)=O)cnc2n1
Structure:
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