Reaction Details Report a problem with these data
Target
Dihydrofolate reductase
Ligand
BDBM50034928
Substrate
n/a
Meas. Tech.
ChEMBL_305729 (CHEMBL829401)
IC50
573.0±n/a nM
Citation
 Gangjee, A; Lin, X CoMFA and CoMSIA analyses of Pneumocystis carinii dihydrofolate reductase, Toxoplasma gondii dihydrofolate reductase, and rat liver dihydrofolate reductase. J Med Chem 48:1448-69 (2005) [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:
BDBM50034928
Synonyms:
5-Methyl-6-(naphthalen-1-ylaminomethyl)-pyrido[2,3-d]pyrimidine-2,4-diamine | CHEMBL23867
Type:
Small organic molecule
Emp. Form.:
C19H18N6
Mol. Mass.:
330.3864
SMILES:
Cc1c(CNc2cccc3ccccc23)cnc2nc(N)nc(N)c12
Structure:
Search PDB for entries with ligand similarity: