Reaction Details |
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Target | 5'-nucleotidase |
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Ligand | BDBM50583397 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_2157216 (CHEMBL5041876) |
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Ki | 0.848000±n/a nM |
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Citation | Scortichini, M; Idris, RM; Moschütz, S; Keim, A; Salmaso, V; Dobelmann, C; Oliva, P; Losenkova, K; Irjala, H; Vaittinen, S; Sandholm, J; Yegutkin, GG; Sträter, N; Junker, A; Müller, CE; Jacobson, KA Structure-Activity Relationship of 3-Methylcytidine-5'-?,?-methylenediphosphates as CD73 Inhibitors. J Med Chem65:2409-2433 (2022) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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5'-nucleotidase |
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Name: | 5'-nucleotidase |
Synonyms: | 5'-NT | 5'-nucleotidase (CD73) | 5NTD_HUMAN | CD_antigen=CD73 | Ecto-5'-nucleotidase | Ecto-5-nucleotidase (e5'NT) | NT5 | NT5E | NTE |
Type: | Enzyme |
Mol. Mass.: | 63371.54 |
Organism: | Homo sapiens (Human) |
Description: | P21589 |
Residue: | 574 |
Sequence: | MCPRAARAPATLLLALGAVLWPAAGAWELTILHTNDVHSRLEQTSEDSSKCVNASRCMGG
VARLFTKVQQIRRAEPNVLLLDAGDQYQGTIWFTVYKGAEVAHFMNALRYDAMALGNHEF
DNGVEGLIEPLLKEAKFPILSANIKAKGPLASQISGLYLPYKVLPVGDEVVGIVGYTSKE
TPFLSNPGTNLVFEDEITALQPEVDKLKTLNVNKIIALGHSGFEMDKLIAQKVRGVDVVV
GGHSNTFLYTGNPPSKEVPAGKYPFIVTSDDGRKVPVVQAYAFGKYLGYLKIEFDERGNV
ISSHGNPILLNSSIPEDPSIKADINKWRIKLDNYSTQELGKTIVYLDGSSQSCRFRECNM
GNLICDAMINNNLRHTDEMFWNHVSMCILNGGGIRSPIDERNNGTITWENLAAVLPFGGT
FDLVQLKGSTLKKAFEHSVHRYGQSTGEFLQVGGIHVVYDLSRKPGDRVVKLDVLCTKCR
VPSYDPLKMDEVYKVILPNFLANGGDGFQMIKDELLRHDSGDQDINVVSTYISKMKVIYP
AVEGRIKFSTGSHCHGSFSLIFLSLWAVIFVLYQ
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BDBM50583397 |
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n/a |
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Name | BDBM50583397 |
Synonyms: | CHEMBL5086866 |
Type | Small organic molecule |
Emp. Form. | C32H57N5O13P2 |
Mol. Mass. | 781.7682 |
SMILES | CCN(CC)CC.CCN(CC)CC.COC(=O)c1ccc(CO\N=c2\ccn([C@@H]3O[C@H](COP(O)(=O)CP(O)(O)=O)[C@@H](O)[C@H]3O)c(=O)n2C)cc1 |r| |
Structure |
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