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TargetPteridine reductase 1
LigandBDBM50398388
Substrate/Competitorn/a
Meas. Tech.ChEMBL_876348 (CHEMBL2185822)
Ki 4170±n/a nM
Citation Corona, PGibellini, FCavalli, ASaxena, PCarta, ALoriga, MLuciani, RPaglietti, GGuerrieri, DNerini, EGupta, SHannaert, VMichels, PAFerrari, SCosti, PM Structure-based selectivity optimization of piperidine-pteridine derivatives as potent Leishmania pteridine reductase inhibitors. J Med Chem55:8318-29 (2012) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Pteridine reductase 1
Name:Pteridine reductase 1
Synonyms:HMTXR | PTR1 | PTR1_LEIMA
Type:PROTEIN
Mol. Mass.:30459.34
Organism:Leishmania major
Description:ChEMBL_1470027
Residue:288
Sequence:
MTAPTVPVALVTGAAKRLGRSIAEGLHAEGYAVCLHYHRSAAEANALSATLNARRPNSAI
TVQADLSNVATAPVSGADGSAPVTLFTRCAELVAACYTHWGRCDVLVNNASSFYPTPLLR
NDEDGHEPCVGDREAMETATADLFGSNAIAPYFLIKAFAHRFAGTPAKHRGTNYSIINMV
DAMTNQPLLGYTIYTMAKGALEGLTRSAALELAPLQIRVNGVGPGLSVLVDDMPPAVWEG
HRSKVPLYQRDSSAAEVSDVVIFLCSSKAKYITGTCVKVDGGYSLTRA
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  Blast E-value cutoff:
BDBM50398388
n/a
NameBDBM50398388
Synonyms:CHEMBL2178604
TypeSmall organic molecule
Emp. Form.C20H22N8O3
Mol. Mass.422.4405
SMILESNc1nc(N)c2nc(CNc3ccc(cc3)C(=O)N3CCC(CC3)C(O)=O)cnc2n1
Structure
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