Reaction Details |
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Target | L-lactate dehydrogenase A chain |
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Ligand | BDBM50425797 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_937561 (CHEMBL2320786) |
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Kd | 19±n/a nM |
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Citation | Kohlmann, A; Zech, SG; Li, F; Zhou, T; Squillace, RM; Commodore, L; Greenfield, MT; Lu, X; Miller, DP; Huang, WS; Qi, J; Thomas, RM; Wang, Y; Zhang, S; Dodd, R; Liu, S; Xu, R; Xu, Y; Miret, JJ; Rivera, V; Clackson, T; Shakespeare, WC; Zhu, X; Dalgarno, DC Fragment growing and linking lead to novel nanomolar lactate dehydrogenase inhibitors. J Med Chem56:1023-40 (2013) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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L-lactate dehydrogenase A chain |
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Name: | L-lactate dehydrogenase A chain |
Synonyms: | Cell proliferation-inducing gene 19 protein | L-lactate dehydrogenase A | L-lactate dehydrogenase A Chain | LDH muscle subunit | LDH-A | LDH-M | LDHA | LDHA_HUMAN | Lactate dehydrogenase A (LDHA) | Renal carcinoma antigen NY-REN-59 |
Type: | Protein |
Mol. Mass.: | 36694.85 |
Organism: | Homo sapiens (Human) |
Description: | P00338::PDB Code: 4ajp |
Residue: | 332 |
Sequence: | MATLKDQLIYNLLKEEQTPQNKITVVGVGAVGMACAISILMKDLADELALVDVIEDKLKG
EMMDLQHGSLFLRTPKIVSGKDYNVTANSKLVIITAGARQQEGESRLNLVQRNVNIFKFI
IPNVVKYSPNCKLLIVSNPVDILTYVAWKISGFPKNRVIGSGCNLDSARFRYLMGERLGV
HPLSCHGWVLGEHGDSSVPVWSGMNVAGVSLKTLHPDLGTDKDKEQWKEVHKQVVESAYE
VIKLKGYTSWAIGLSVADLAESIMKNLRRVHPVSTMIKGLYGIKDDVFLSVPCILGQNGI
SDLVKVTLTSEEEARLKKSADTLWGIQKELQF
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BDBM50425797 |
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n/a |
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Name | BDBM50425797 |
Synonyms: | CHEMBL2316885 |
Type | Small organic molecule |
Emp. Form. | C33H32ClFN4O11S |
Mol. Mass. | 747.144 |
SMILES | COc1cc(OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CNc2cc(F)cc(c2)-c2ccc(cn2)C(O)=O)c(Cl)cc1NC(=O)CSc1ccc(cn1)C(O)=O |r| |
Structure |
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