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Target
Dihydrofolate reductase
Ligand
BDBM50056231
Substrate
n/a
Meas. Tech.
ChEMBL_52985 (CHEMBL665254)
IC50
5300±n/a nM
Citation
 Gangjee, A; Devraj, R; Queener, SF Synthesis and dihydrofolate reductase inhibitory activities of 2,4-diamino-5-deaza and 2,4-diamino-5,10-dideaza lipophilic antifolates. J Med Chem 40:470-8 (1997) [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:
BDBM50056231
Synonyms:
6-[(E)-2-(4-Methoxy-phenyl)-vinyl]-pyrido[2,3-d]pyrimidine-2,4-diamine | 6-[2-((E)-4-Methoxy-phenyl)-vinyl]-pyrido[2,3-d]pyrimidine-2,4-diamine | CHEMBL145005
Type:
Small organic molecule
Emp. Form.:
C16H15N5O
Mol. Mass.:
293.3232
SMILES:
COc1ccc(\C=C\c2cnc3nc(N)nc(N)c3c2)cc1
Structure:
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