Reaction Details |
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Target | Peptidyl-prolyl cis-trans isomerase A |
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Ligand | BDBM50230213 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1644714 (CHEMBL3993643) |
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Kd | 64±n/a nM |
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Citation | Steadman, VA; Pettit, SB; Poullennec, KG; Lazarides, L; Keats, AJ; Dean, DK; Stanway, SJ; Austin, CA; Sanvoisin, JA; Watt, GM; Fliri, HG; Liclican, AC; Jin, D; Wong, MH; Leavitt, SA; Lee, YJ; Tian, Y; Frey, CR; Appleby, TC; Schmitz, U; Jansa, P; Mackman, RL; Schultz, BE Discovery of Potent Cyclophilin Inhibitors Based on the Structural Simplification of Sanglifehrin A. J Med Chem60:1000-1017 (2017) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Peptidyl-prolyl cis-trans isomerase A |
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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: | MVNPTVFFDIAVDGEPLGRVSFELFADKVPKTAENFRALSTGEKGFGYKGSCFHRIIPGF
MCQGGDFTRHNGTGGKSIYGEKFEDENFILKHTGPGILSMANAGPNTNGSQFFICTAKTE
WLDGKHVVFGKVKEGMNIVEAMERFGSRNGKTSKKITIADCGQLE
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BDBM50230213 |
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n/a |
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Name | BDBM50230213 |
Synonyms: | CHEMBL4092526 |
Type | Small organic molecule |
Emp. Form. | C35H46N4O7 |
Mol. Mass. | 634.7623 |
SMILES | CO[C@@H]1CC\C=C\c2cccc(COC(=O)[C@@H]3CCCN(N3)C(=O)[C@H](Cc3cccc(O)c3)NC(=O)[C@@H](NC(=O)[C@@H]1C)C(C)C)c2 |r,t:5| |
Structure |
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