Reaction Details |
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Target | Ectonucleoside triphosphate diphosphohydrolase 3 |
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Ligand | BDBM50307835 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_612642 (CHEMBL1065679) |
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Ki | >60000±n/a nM |
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Citation | Baqi, Y; Lee, SY; Iqbal, J; Ripphausen, P; Lehr, A; Scheiff, AB; Zimmermann, H; Bajorath, J; Müller, CE Development of potent and selective inhibitors of ecto-5'-nucleotidase based on an anthraquinone scaffold. J Med Chem53:2076-86 (2010) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Ectonucleoside triphosphate diphosphohydrolase 3 |
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Name: | Ectonucleoside triphosphate diphosphohydrolase 3 |
Synonyms: | CD39L3 | ENTP3_HUMAN | ENTPD3 |
Type: | PROTEIN |
Mol. Mass.: | 59103.51 |
Organism: | Homo sapiens (Human) |
Description: | ChEMBL_612642 |
Residue: | 529 |
Sequence: | MFTVLTRQPCEQAGLKALYRTPTIIALVVLLVSIVVLVSITVIQIHKQEVLPPGLKYGIV
LDAGSSRTTVYVYQWPAEKENNTGVVSQTFKCSVKGSGISSYGNNPQDVPRAFEECMQKV
KGQVPSHLHGSTPIHLGATAGMRLLRLQNETAANEVLESIQSYFKSQPFDFRGAQIISGQ
EEGVYGWITANYLMGNFLEKNLWHMWVHPHGVETTGALDLGGASTQISFVAGEKMDLNTS
DIMQVSLYGYVYTLYTHSFQCYGRNEAEKKFLAMLLQNSPTKNHLTNPCYPRDYSISFTM
GHVFDSLCTVDQRPESYNPNDVITFEGTGDPSLCKEKVASIFDFKACHDQETCSFDGVYQ
PKIKGPFVAFAGFYYTASALNLSGSFSLDTFNSSTWNFCSQNWSQLPLLLPKFDEVYARS
YCFSANYIYHLFVNGYKFTEETWPQIHFEKEVGNSSIAWSLGYMLSLTNQIPAESPLIRL
PIEPPVFVGTLAFFTAAALLCLAFLAYLCSATRRKRHSEHAFDHAVDSD
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BDBM50307835 |
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n/a |
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Name | BDBM50307835 |
Synonyms: | CHEMBL590956 | Sodium 1-amino-4-[4-fluoro-2-carboxyphenylamino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate |
Type | Small organic molecule |
Emp. Form. | C21H12FN2O7S |
Mol. Mass. | 455.393 |
SMILES | Nc1c(cc(Nc2ccc(F)cc2C(O)=O)c2C(=O)c3ccccc3C(=O)c12)S([O-])(=O)=O |
Structure |
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