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Target
Dihydrofolate reductase
Ligand
BDBM50029773
Substrate
n/a
Meas. Tech.
ChEMBL_52981 (CHEMBL876710)
IC50
3100±n/a nM
Citation
 Queener, SF New drug developments for opportunistic infections in immunosuppressed patients: Pneumocystis carinii. J Med Chem 38:4739-59 (1996) [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:
BDBM50029773
Synonyms:
7,9-Diamino-3-(3,4,5-trimethoxy-benzyl)-3,5-dihydro-3,5,6,8-tetraaza-cyclopenta[a]naphthalen-4-one | CHEMBL423939
Type:
Small organic molecule
Emp. Form.:
C19H20N6O4
Mol. Mass.:
396.3999
SMILES:
COc1cc(Cn2ccc3c2c(=O)[nH]c2nc(N)nc(N)c32)cc(OC)c1OC
Structure:
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