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Reaction Details
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TargetDihydrofolate reductase
LigandBDBM50108175
Substrate/Competitorn/a
Meas. Tech.ChEMBL_55098 (CHEMBL665358)
IC50 3300±n/a nM
Citation Rosowsky, AForsch, RAQueener, SF Inhibition of Pneumocystis carinii, Toxoplasma gondii, and Mycobacterium avium dihydrofolate reductases by 2,4-diamino-5-[2-methoxy-5-(omega-carboxyalkyloxy)benzyl]pyrimidines: marked improvement in potency relative to trimethoprim and species selectivity relative to piritrexim. J Med Chem45:233-41 (2001) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Dihydrofolate reductase
Name:Dihydrofolate reductase
Synonyms:Dihydrofolate reductase (DHFR) | Tetrahydrofolate dehydrogenase
Type:Enzyme
Mol. Mass.:19884.75
Organism:Mycobacterium avium
Description:Recombinant Mycobacterium avium DHFR expressed in E. coli.
Residue:181
Sequence:
MTRAEVGLVWAQSTSGVIGRGGDIPWSVPEDLTRFKEVTMGHTVIMGRRTWESLPAKVRP
LPGRRNVVVSRRPDFVAEGARVAGSLEAALAYAGSDPAPWVIGGAQIYLLALPHATRCEV
TEIEIDLRRDDDDALAPALDDSWVGETGEWLASRSGLRYRFHSYRRDPRSSVRGCSPSRP
S
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BDBM50108175
n/a
NameBDBM50108175
Synonyms:5-(2-Methoxy-5-octyloxy-benzyl)-pyrimidine-2,4-diamine | CHEMBL78648
TypeSmall organic molecule
Emp. Form.C20H30N4O2
Mol. Mass.358.4778
SMILESCCCCCCCCOc1ccc(OC)c(Cc2cnc(N)nc2N)c1
Structure
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