Reaction Details Report a problem with these data
Target
Dihydrofolate reductase
Ligand
BDBM50316126
Substrate
n/a
Meas. Tech.
ChEMBL_623482 (CHEMBL1113553)
IC50
22000±n/a nM
Citation
Al-Omary, FA; Abou-Zeid, LA; Nagi, MN; Habib, el-SE; Abdel-Aziz, AA; El-Azab, AS; Abdel-Hamide, SG; Al-Omar, MA; Al-Obaid, AM; El-Subbagh, HI Non-classical antifolates. Part 2: synthesis, biological evaluation, and molecular modeling study of some new 2,6-substituted-quinazolin-4-ones. Bioorg Med Chem 18:2849-63 (2010) [PubMed] Article
More Info.:
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:
BDBM50316126
Synonyms:
Bleph-10 | Bleph-30 | Blephamide | CHEMBL455 | Cetamide | Cetapred | FML-S | Klaron | Metimyd | N-Acetyl-4-amino-benzenesulfonamide | Ocusulf-10 | Ocusulf-30 | Predamide | Predsulfair | SULF-10 | SULF-15 | SULFACETAMIDE | Sulfacel-15 | Sulfacetamide, 1 | Sulfair-15 | Sulphacetamide | Sulphrin | Sulster | Sulten-10 | Vasocidin
Type:
Small organic molecule
Emp. Form.:
C8H10N2O3S
Mol. Mass.:
214.242
SMILES:
CC(=O)NS(=O)(=O)c1ccc(N)cc1