Reaction Details |
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Target | Pantetheinase |
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Ligand | BDBM475868 |
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Substrate/Competitor | n/a |
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Meas. Tech. | Enzymatic Assay |
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IC50 | 0.200±n/a nM |
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Citation | Godbout, C; Fleck, MT; Koolman, HF Heteroaromatic compounds as Vanin inhibitors US Patent US10864201 Publication Date 12/15/2020 |
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More Info.: | Get all data from this article, Assay Method |
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Pantetheinase |
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Name: | Pantetheinase |
Synonyms: | Pantetheine hydrolase | Tiff66 | VNN1 | VNN1_HUMAN | Vanin-1 | Vascular non-inflammatory molecule 1 |
Type: | Enzyme Catalytic Domain |
Mol. Mass.: | 57002.46 |
Organism: | Homo sapiens (Human) |
Description: | O95497 |
Residue: | 513 |
Sequence: | MTTQLPAYVAILLFYVSRASCQDTFTAAVYEHAAILPNATLTPVSREEALALMNRNLDIL
EGAITSAADQGAHIIVTPEDAIYGWNFNRDSLYPYLEDIPDPEVNWIPCNNRNRFGQTPV
QERLSCLAKNNSIYVVANIGDKKPCDTSDPQCPPDGRYQYNTDVVFDSQGKLVARYHKQN
LFMGENQFNVPKEPEIVTFNTTFGSFGIFTCFDILFHDPAVTLVKDFHVDTIVFPTAWMN
VLPHLSAVEFHSAWAMGMRVNFLASNIHYPSKKMTGSGIYAPNSSRAFHYDMKTEEGKLL
LSQLDSHPSHSAVVNWTSYASSIEALSSGNKEFKGTVFFDEFTFVKLTGVAGNYTVCQKD
LCCHLSYKMSENIPNEVYALGAFDGLHTVEGRYYLQICTLLKCKTTNLNTCGDSAETAST
RFEMFSLSGTFGTQYVFPEVLLSENQLAPGEFQVSTDGRLFSLKPTSGPVLTVTLFGRLY
EKDWASNASSGLTAQARIIMLIVIAPIVCSLSW
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BDBM475868 |
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n/a |
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Name | BDBM475868 |
Synonyms: | N-[(3S)-1-[(2R)-2-(4-Fluorophenyl)-2-methyl-1H,2H,3H-pyrrolo[2,3-b]lpyridine-5-carbonyl]-pyrrolidin-3-yl]-N-methylacetamide | US10864201, Ex. 6 |
Type | Small organic molecule |
Emp. Form. | C22H25FN4O2 |
Mol. Mass. | 396.4579 |
SMILES | CN([C@H]1CCN(C1)C(=O)c1cnc2N[C@](C)(Cc2c1)c1ccc(F)cc1)C(C)=O |r| |
Structure |
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