Reaction Details Report a problem with these data
Target
Dihydrofolate reductase
Ligand
BDBM50508925
Substrate
n/a
Meas. Tech.
ChEMBL_1835740 (CHEMBL4335873)
IC50
94.9±n/a nM
Citation
 Patel, TS; Bhatt, JD; Dixit, RB; Chudasama, CJ; Patel, BD; Dixit, BC Green synthesis, biological evaluation, molecular docking studies and 3D-QSAR analysis of novel phenylalanine linked quinazoline-4(3H)-one-sulphonamide hybrid entities distorting the malarial reductase activity in folate pathway. Bioorg Med Chem 27:3574-3586 (2019) [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:
BDBM50508925
Synonyms:
CHEMBL4437261
Type:
Small organic molecule
Emp. Form.:
C32H29N5O4S
Mol. Mass.:
579.669
SMILES:
CC(=O)Nc1ccc(cc1)S(=O)(=O)NC(Cc1ccccc1)c1nc2ccccc2c(=O)n1\N=C\c1ccc(C)cc1
Structure:
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