Reaction Details Report a problem with these data
Target
Dihydrofolate reductase
Ligand
BDBM50227971
Substrate
n/a
Meas. Tech.
ChEMBL_53635 (CHEMBL666664)
IC50
41900±n/a nM
Citation
 Kralovec, J; Spencer, G; Blair, AH; Mammen, M; Singh, M; Ghose, T Synthesis of methotrexate-antibody conjugates by regiospecific coupling and assessment of drug and antitumor activities. J Med Chem 32:2426-31 (1989) [PubMed]  Article 
Target
Name:
Dihydrofolate reductase
Synonyms:
DHFR | DYR_BOVIN | Dihydrofolate reductase | Dihydrofolate reductase (DHFR)
Type:
Enzyme
Mol. Mass.:
21603.71
Organism:
Bos taurus (Cattle)
Description:
P00376
Residue:
187
Sequence:
MVRPLNCIVAVSQNMGIGKNGDLPWPPLRNEFQYFQRMTTVSSVEGKQNLVIMGRKTWFSIPEKNRPLKDRINIVLSRELKEPPKGAHFLAKSLDDALELIEDPELTNKVDVVWIVGGSSVYKEAMNKPGHVRLFVTRIMQEFESDAFFPEIDFEKYKLLPEYPGVPLDVQEEKGIKYKFEVYEKNN
  
Inhibitor
Name:
BDBM50227971
Synonyms:
CHEMBL32501
Type:
Small organic molecule
Emp. Form.:
C24H32N10O4
Mol. Mass.:
524.5755
SMILES:
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)NC(CCC(=O)NN)C(=O)OC(C)(C)C
Structure:
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