Reaction Details |
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Target | Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 |
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Ligand | BDBM50453240 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1749378 (CHEMBL4183888) |
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IC50 | 1200±n/a nM |
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Citation | Zelikman, V; Pelletier, J; Simhaev, L; Sela, A; Gendron, FP; Arguin, G; Senderowitz, H; Sévigny, J; Fischer, B Highly Selective and Potent Ectonucleotide Pyrophosphatase-1 (NPP1) Inhibitors Based on Uridine 5'-P J Med Chem61:3939-3951 (2018) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 |
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Name: | Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 |
Synonyms: | ENPP1 | ENPP1_HUMAN | M6S1 | NPPS | PC1 | PDNP1 |
Type: | PROTEIN |
Mol. Mass.: | 104934.43 |
Organism: | Homo sapiens (Human) |
Description: | ChEMBL_1448940 |
Residue: | 925 |
Sequence: | MERDGCAGGGSRGGEGGRAPREGPAGNGRDRGRSHAAEAPGDPQAAASLLAPMDVGEEPL
EKAARARTAKDPNTYKVLSLVLSVCVLTTILGCIFGLKPSCAKEVKSCKGRCFERTFGNC
RCDAACVELGNCCLDYQETCIEPEHIWTCNKFRCGEKRLTRSLCACSDDCKDKGDCCINY
SSVCQGEKSWVEEPCESINEPQCPAGFETPPTLLFSLDGFRAEYLHTWGGLLPVISKLKK
CGTYTKNMRPVYPTKTFPNHYSIVTGLYPESHGIIDNKMYDPKMNASFSLKSKEKFNPEW
YKGEPIWVTAKYQGLKSGTFFWPGSDVEINGIFPDIYKMYNGSVPFEERILAVLQWLQLP
KDERPHFYTLYLEEPDSSGHSYGPVSSEVIKALQRVDGMVGMLMDGLKELNLHRCLNLIL
ISDHGMEQGSCKKYIYLNKYLGDVKNIKVIYGPAARLRPSDVPDKYYSFNYEGIARNLSC
REPNQHFKPYLKHFLPKRLHFAKSDRIEPLTFYLDPQWQLALNPSERKYCGSGFHGSDNV
FSNMQALFVGYGPGFKHGIEADTFENIEVYNLMCDLLNLTPAPNNGTHGSLNHLLKNPVY
TPKHPKEVHPLVQCPFTRNPRDNLGCSCNPSILPIEDFQTQFNLTVAEEKIIKHETLPYG
RPRVLQKENTICLLSQHQFMSGYSQDILMPLWTSYTVDRNDSFSTEDFSNCLYQDFRIPL
SPVHKCSFYKNNTKVSYGFLSPPQLNKNSSGIYSEALLTTNIVPMYQSFQVIWRYFHDTL
LRKYAEERNGVNVVSGPVFDFDYDGRCDSLENLRQKRRVIRNQEILIPTHFFIVLTSCKD
TSQTPLHCENLDTLAFILPHRTDNSESCVHGKHDSSWVEELLMLHRARITDVEHITGLSF
YQQRKEPVSDILKLKTHLPTFSQED
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BDBM50453240 |
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n/a |
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Name | BDBM50453240 |
Synonyms: | CHEMBL4218881 |
Type | Small organic molecule |
Emp. Form. | C9H15N2O13P3S2 |
Mol. Mass. | 516.272 |
SMILES | O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COP(S)(=S)OP(O)(=O)OP(O)(O)=O)n1ccc(=O)[nH]c1=O |r| |
Structure |
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