Reaction Details | |||
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Target | Peptidyl-prolyl cis-trans isomerase A | ||
Ligand | BDBM50330181 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_676203 (CHEMBL1273323) | ||
IC50 | 83.5±n/a nM | ||
Citation | Scribner, A; Houck, D; Huang, Z; Mosier, S; Peel, M; Scorneaux, B Synthesis and biological evaluation of [D-lysine]8cyclosporin A analogs as potential anti-HCV agents. Bioorg Med Chem Lett20:6542-6 (2010) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Peptidyl-prolyl cis-trans isomerase A | |||
Name: | Peptidyl-prolyl cis-trans isomerase A | ||
Synonyms: | CYPA | CYPA PPIase | Cyclophilin A | Cyclosporin A-binding protein | PPIA | PPIA_HUMAN | PPIase A | Peptidyl-prolyl cis-trans isomerase A | Rotamase A | ||
Type: | Protein | ||
Mol. Mass.: | 18015.32 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P62937 | ||
Residue: | 165 | ||
Sequence: |
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BDBM50330181 | |||
n/a | |||
Name | BDBM50330181 | ||
Synonyms: | CHEMBL1269579 | tert-butyl((2R,5S,8S,11S,14S,17S,23S,26S,29S,32S)-17-ethyl-14-((1R,2R)-1-hydroxy-2-methylhex-4-enyl)-5,8,23,29-tetraisobutyl-11,26-diisopropyl-4,7,10,13,19,22,28,32-octamethyl-3,6,9,12,15,18,21,24,27,30,33-undecaoxo-1,4,7,10,13,16,19,22,25,28,31-undecaazacyclotritriacontan-2-yl)methylcarbamate | ||
Type | Small organic molecule | ||
Emp. Form. | C67H120N12O14 | ||
Mol. Mass. | 1317.7417 | ||
SMILES | CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CNC(=O)OC(C)(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C |r| | ||
Structure |