Reaction Details |
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Target | Pteridine reductase 1 |
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Ligand | BDBM50303514 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_596055 (CHEMBL1037349) |
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Ki | 2600±n/a nM |
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Citation | Tulloch, LB; Martini, VP; Iulek, J; Huggan, JK; Lee, JH; Gibson, CL; Smith, TK; Suckling, CJ; Hunter, WN Structure-based design of pteridine reductase inhibitors targeting African sleeping sickness and the leishmaniases. J Med Chem53:221-9 (2010) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Pteridine reductase 1 |
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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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BDBM50303514 |
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n/a |
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Name | BDBM50303514 |
Synonyms: | 2-amino-6-(1,3-benzodioxol-5-yl)-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile | 2-amino-6-(benzo[d][1,3]dioxol-5-yl)-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile | CHEMBL568414 |
Type | Small organic molecule |
Emp. Form. | C14H9N5O3 |
Mol. Mass. | 295.253 |
SMILES | Nc1nc2[nH]c(c(C#N)c2c(=O)[nH]1)-c1ccc2OCOc2c1 |
Structure |
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