Reaction Details Report a problem with these data
Target
Dihydrofolate reductase
Ligand
BDBM50253580
Substrate
n/a
Meas. Tech.
ChEMBL_538596 (CHEMBL1026634)
IC50
7.2±n/a nM
Citation
 Gangjee, A; Adair, OO; Pagley, M; Queener, SF N9-substituted 2,4-diaminoquinazolines: synthesis and biological evaluation of lipophilic inhibitors of pneumocystis carinii and toxoplasma gondii dihydrofolate reductase. J Med Chem 51:6195-200 (2008) [PubMed]  Article 
Target
Name:
Dihydrofolate reductase
Synonyms:
DYR_PNECA | Dihydrofolate Reductase (DHFR) | Dihydrofolate reductase | Dihydrofolate reductase; P. carinii vs rat | Tetrahydrofolate dehydrogenase
Type:
Enzyme
Mol. Mass.:
23891.29
Organism:
Pneumocystis carinii
Description:
n/a
Residue:
206
Sequence:
MNQQKSLTLIVALTTSYGIGRSNSLPWKLKKEISYFKRVTSFVPTFDSFESMNVVLMGRKTWESIPLQFRPLKGRINVVITRNESLDLGNGIHSAKSLDHALELLYRTYGSESSVQINRIFVIGGAQLYKAAMDHPKLDRIMATIIYKDIHCDVFFPLKFRDKEWSSVWKKEKHSDLESWVGTKVPHGKINEDGFDYEFEMWTRDL
  
Inhibitor
Name:
BDBM50253580
Synonyms:
2,4-Diamino-6-[N-(beta-naphthyl)-N-ethylamino]quinazoline | CHEMBL522678
Type:
Small organic molecule
Emp. Form.:
C21H21N5
Mol. Mass.:
343.4249
SMILES:
CCN(Cc1ccc2ccccc2c1)c1ccc2nc(N)nc(N)c2c1
Structure:
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