Target
Peptidyl-prolyl cis-trans isomerase FKBP1A
Ligand
BDBM50132547
Substrate
n/a
Meas. Tech.
ChEMBL_138591 (CHEMBL746519)
IC50
1530±n/a nM
Citation
 Yang, WRozamus, LWNarula, SRollins, CTYuan, RAndrade, LJRam, MKPhillips, TBvan Schravendijk, MRDalgarno, DClackson, THolt, DA Investigating protein-ligand interactions with a mutant FKBP possessing a designed specificity pocket. J Med Chem 43:1135-42 (2000) [PubMed]  Article 
Target
Name:
Peptidyl-prolyl cis-trans isomerase FKBP1A
Synonyms:
12 kDa FK506-binding protein | 12 kDa FKBP | FK506-binding protein 1A | FK506-binding protein 1A (FKBP12) | FKB1A_HUMAN | FKBP-12 | FKBP-1A | FKBP1 | FKBP12 | FKBP1A | Immunophilin FKBP12 | PPIase | PPIase FKBP1A | Peptidyl-prolyl cis-trans isomerase (FKBP) | Rotamase | RyR1/FKBP12 | mTOR/FKBP12A/FKBP12B
Type:
Isomerase
Mol. Mass.:
11953.09
Organism:
Homo sapiens (Human)
Description:
P62942
Residue:
108
Sequence:
MGVQVETISPGDGRTFPKRGQTCVVHYTGMLEDGKKFDSSRDRNKPFKFMLGKQEVIRGWEEGVAQMSVGQRAKLTISPDYAYGATGHPGIIPPHATLVFDVELLKLE
  
Inhibitor
Name:
BDBM50132547
Synonyms:
1-Phenylacetyl-piperidine-2-carboxylic acid 1-(3-carboxymethoxy-phenyl)-3-(3,4-dimethoxy-phenyl)-propyl ester | CHEMBL325083
Type:
Small organic molecule
Emp. Form.:
C33H37NO8
Mol. Mass.:
575.6488
SMILES:
COc1ccc(CC[C@@H](OC(=O)[C@@H]2CCCCN2C(=O)Cc2ccccc2)c2cccc(OCC(O)=O)c2)cc1OC
Structure:
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