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TargetBifunctional dihydrofolate reductase-thymidylate synthase
LigandBDBM50562455
Substrate/Competitorn/a
Meas. Tech.ChEMBL_2078721 (CHEMBL4734512)
IC50 360±n/a nM
Citation Bibi, MQureshi, NASadiq, AFarooq, UHassan, AShaheen, NAsghar, IUmer, DUllah, AKhan, FASalman, MBibi, ARashid, U Exploring the ability of dihydropyrimidine-5-carboxamide and 5-benzyl-2,4-diaminopyrimidine-based analogues for the selective inhibition of L. major dihydrofolate reductase. Eur J Med Chem210:0 (2021) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Bifunctional dihydrofolate reductase-thymidylate synthase
Name:Bifunctional dihydrofolate reductase-thymidylate synthase
Synonyms:DHFR-TS | DRTS_LEIMA | Thymidylate synthase (TS)
Type:Protein
Mol. Mass.:58691.04
Organism:Leishmania major
Description:P07382
Residue:520
Sequence:
MSRAAARFKIPMPETKADFAFPSLRAFSIVVALDMQHGIGDGESIPWRVPEDMTFFKNQT
TLLRNKKPPTEKKRNAVVMGRKTWESVPVKFRPLKGRLNIVLSSKATVEELLAPLPEGQR
AAAAQDVVVVNGGLAEALRLLARPLYCSSIETAYCVGGAQVYADAMLSPCIEKLQEVYLT
RIYATAPACTRFFPFPPENAATAWDLASSQGRRKSEAEGLEFEICKYVPRNHEERQYLEL
IDRIMKTGIVKEDRTGVGTISLFGAQMRFSLRDNRLPLLTTKRVFWRGVCEELLWFLRGE
TSAQLLADKDIHIWDGNGSREFLDSRGLTENKEMDLGPVYGFQWRHFGADYKGFEANYDG
EGVDQIKLIVETIKTNPNDRRLLVTAWNPCALQKMALPPCHLLAQFYVNTDTSELSCMLY
QRSCDMGLGVPFNIASYALLTILIAKATGLRPGELVHTLGDAHVYRNHVDALKAQLERVP
HAFPTLIFKEERQYLEDYELTDMEVIDYVPHPAIKMEMAV
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  Blast E-value cutoff:
BDBM50562455
n/a
NameBDBM50562455
Synonyms:CHEMBL2005041
TypeSmall organic molecule
Emp. Form.C22H23N5O2
Mol. Mass.389.4503
SMILESNc1nc(N)c(CCCCc2ccccc2)c(\C=C\c2ccc(cc2)[N+]([O-])=O)n1
Structure
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