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Target
5'-nucleotidase
Ligand
BDBM650295
Substrate
n/a
Meas. Tech.
CD73 Biochemical IC50 Assay
IC50
0.410±n/a nM
Citation
 Bartlett, MJ; Chin, GF; Clarke, MO; Cosman, JL; Ensan, D; Goyal, B; Ho, S; Hui, HC; Mackman, RL; Mish, MR; Schroeder, SD; Shapiro, ND; Siegel, DS; Tang, DT; Yang, H CD73 COMPOUNDS US Patent  US20240043427 Publication Date 2/8/2024 
Target
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:
MCPRAARAPATLLLALGAVLWPAAGAWELTILHTNDVHSRLEQTSEDSSKCVNASRCMGGVARLFTKVQQIRRAEPNVLLLDAGDQYQGTIWFTVYKGAEVAHFMNALRYDAMALGNHEFDNGVEGLIEPLLKEAKFPILSANIKAKGPLASQISGLYLPYKVLPVGDEVVGIVGYTSKETPFLSNPGTNLVFEDEITALQPEVDKLKTLNVNKIIALGHSGFEMDKLIAQKVRGVDVVVGGHSNTFLYTGNPPSKEVPAGKYPFIVTSDDGRKVPVVQAYAFGKYLGYLKIEFDERGNVISSHGNPILLNSSIPEDPSIKADINKWRIKLDNYSTQELGKTIVYLDGSSQSCRFRECNMGNLICDAMINNNLRHTDEMFWNHVSMCILNGGGIRSPIDERNNGTITWENLAAVLPFGGTFDLVQLKGSTLKKAFEHSVHRYGQSTGEFLQVGGIHVVYDLSRKPGDRVVKLDVLCTKCRVPSYDPLKMDEVYKVILPNFLANGGDGFQMIKDELLRHDSGDQDINVVSTYISKMKVIYPAVEGRIKFSTGSHCHGSFSLIFLSLWAVIFVLYQ
  
Inhibitor
Name:
BDBM650295
Synonyms:
US20240043427, Example 388
Type:
Small organic molecule
Emp. Form.:
C25H18ClF3N6O3
Mol. Mass.:
542.897
SMILES:
FC(F)(F)CN1C(=O)C2(CC2)c2ccc(cc12)[C@H]1C[C@@H]1c1cc(nn2c(Cl)cnc12)-c1c[nH]c(=O)[nH]c1=O |r|
Structure:
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