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Target
Peptidyl-prolyl cis-trans isomerase FKBP1B
Ligand
BDBM50575675
Substrate
n/a
Meas. Tech.
ChEMBL_2125783 (CHEMBL4835128)
Kd
301±n/a nM
Citation
 Bauder, M; Meyners, C; Purder, PL; Merz, S; Sugiarto, WO; Voll, AM; Heymann, T; Hausch, F Structure-Based Design of High-Affinity Macrocyclic FKBP51 Inhibitors. J Med Chem 64:3320-3349 (2021) [PubMed]  Article 
Target
Name:
Peptidyl-prolyl cis-trans isomerase FKBP1B
Synonyms:
12.6 kDa FKBP | FK506-binding protein 1B | FKB1B_HUMAN | FKBP-12.6 | FKBP-1B | FKBP12.6 | FKBP1B | FKBP1L | FKBP9 | Immunophilin FKBP12.6 | OTK4 | PPIase FKBP1B | Peptidyl-prolyl cis-trans isomerase FKBP1B | Rotamase | h-FKBP-12 | mTOR/FKBP12A/FKBP12B
Type:
PROTEIN
Mol. Mass.:
11785.40
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1458980
Residue:
108
Sequence:
MGVEIETISPGDGRTFPKKGQTCVVHYTGMLQNGKKFDSSRDRNKPFKFRIGKQEVIKGFEEGAAQMSLGQRAKLTCTPDVAYGATGHPGVIPPNATLIFDVELLNLE
  
Inhibitor
Name:
BDBM50575675
Synonyms:
CHEMBL4856203
Type:
Small organic molecule
Emp. Form.:
C45H57NO10
Mol. Mass.:
771.9348
SMILES:
COc1ccc(CC[C@H]2OC(=O)[C@@H]3CCCCN3C(=O)[C@@H](C3CCCCC3)c3cc(OC)c(OC)c(OCCOC\C=C/COc4cccc2c4)c3)cc1OC |r,c:43|
Structure:
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