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Target
Dihydrofolate reductase
Ligand
BDBM50316139
Substrate
n/a
Meas. Tech.
ChEMBL_623482 (CHEMBL1113553)
IC50
10000±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 
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:
BDBM50316139
Synonyms:
Bis(1-allyl-6-nitro-quinazolin-4(1H)-one-2-yl)-disulfide hydrochloride | CHEMBL1091243
Type:
Small organic molecule
Emp. Form.:
C22H16N6O6S2
Mol. Mass.:
524.529
SMILES:
[O-][N+](=O)c1ccc2n(CC=C)c(SSc3nc(=O)c4cc(ccc4n3CC=C)[N+]([O-])=O)nc(=O)c2c1
Structure:
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