Reaction Details |
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Target | CTP synthase 1 |
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Ligand | BDBM50609652 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_2278964 |
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IC50 | 570±n/a nM |
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Citation | Novak, A; Laughton, D; Lane, R; Blackham, E; Thomas, J; Chatzopoulou, E; Wrigglesworth, J; Quddus, A; Ahmed, S; Cousin, D; Duffy, L; Dubois, N; Unitt, J; Orban, K; Browne, E; Ward, M; Mycock, D; Ieva, M; Bland, N; George, P; Bourne, T; Asnagli, H; Birch, L; Jones, G Discovery and Optimization of Potent and Orally Available CTP Synthetase Inhibitors for Use in Treatment of Diseases Driven by Aberrant Immune Cell Proliferation. J Med Chem65:16640-16650 (2022) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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CTP synthase 1 |
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Name: | CTP synthase 1 |
Synonyms: | 6.3.4.2 | CTP synthase 1 | CTP synthetase 1 | CTPS1 | Synonyms=CTPS | UTP--ammonia ligase 1 |
Type: | PROTEIN |
Mol. Mass.: | 66688.58 |
Organism: | Homo sapiens |
Description: | ChEMBL_120890 |
Residue: | 591 |
Sequence: | MKYILVTGGVISGIGKGIIASSVGTILKSCGLHVTSIKIDPYINIDAGTFSPYEHGEVFV
LDDGGEVDLDLGNYERFLDIRLTKDNNLTTGKIYQYVINKERKGDYLGKTVQVVPHITDA
IQEWVMRQALIPVDEDGLEPQVCVIELGGTVGDIESMPFIEAFRQFQFKVKRENFCNIHV
SLVPQPSSTGEQKTKPTQNSVRELRGLGLSPDLVVCRCSNPLDTSVKEKISMFCHVEPEQ
VICVHDVSSIYRVPLLLEEQGVVDYFLRRLDLPIERQPRKMLMKWKEMADRYDRLLETCS
IALVGKYTKFSDSYASVIKALEHSALAINHKLEIKYIDSADLEPITSQEEPVRYHEAWQK
LCSAHGVLVPGGFGVRGTEGKIQAIAWARNQKKPFLGVCLGMQLAVVEFSRNVLGWQDAN
STEFDPTTSHPVVVDMPEHNPGQMGGTMRLGKRRTLFQTKNSVMRKLYGDADYLEERHRH
RFEVNPVWKKCLEEQGLKFVGQDVEGERMEIVELEDHPFFVGVQYHPEFLSRPIKPSPPY
FGLLLASVGRLSHYLQKGCRLSPRDTYSDRSGSSSPDSEITELKFPSINHD
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BDBM50609652 |
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n/a |
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Name | BDBM50609652 |
Synonyms: | CHEMBL5284514 |
Type | Small organic molecule |
Emp. Form. | C15H16ClN3O3S2 |
Mol. Mass. | 385.889 |
SMILES | CN(C(=O)Cc1csc(NS(=O)(=O)C2CC2)n1)c1cccc(Cl)c1 |
Structure |
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