Reaction Details Report a problem with these data
Target
Dihydrofolate reductase
Ligand
BDBM50029761
Substrate
n/a
Meas. Tech.
ChEMBL_52981 (CHEMBL876710)
IC50
10600±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:
BDBM50029761
Synonyms:
5-[4-Chloro-3-(dimethylaminomethyl-amino)-phenyl]-6-ethyl-pyrimidine-2,4-diamine | CHEMBL145060
Type:
Small organic molecule
Emp. Form.:
C15H21ClN6
Mol. Mass.:
320.82
SMILES:
CCc1nc(N)nc(N)c1-c1ccc(Cl)c(NCN(C)C)c1
Structure:
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