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Target
Peptidyl-prolyl cis-trans isomerase FKBP1A
Ligand
BDBM50080533
Substrate
n/a
Meas. Tech.
ChEMBL_66270 (CHEMBL678140)
IC50
>200000±n/a nM
Citation
 Christner, C; Wyrwa, R; Marsch, S; Küllertz, G; Thiericke, R; Grabley, S; Schumann, D; Fischer, G Synthesis and cytotoxic evaluation of cycloheximide derivatives as potential inhibitors of FKBP12 with neuroregenerative properties. J Med Chem 42:3615-22 (1999) [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:
BDBM50080533
Synonyms:
CHEMBL331865 | {4-[(R)-2-(Adamantan-1-ylcarbamoyloxy)-2-((1S,3S,5S)-3,5-dimethyl-2-oxo-cyclohexyl)-ethyl]-2,6-dioxo-piperidin-1-yl}-acetic acid ethyl ester
Type:
Small organic molecule
Emp. Form.:
C30H44N2O7
Mol. Mass.:
544.6796
SMILES:
CCOC(=O)CN1C(=O)CC(C[C@@H](OC(=O)NC23C[C@H]4C[C@H](C[C@H](C4)C2)C3)[C@@H]2C[C@@H](C)C[C@H](C)C2=O)CC1=O |TLB:24:23:26:19.18.20,24:19:26:23.25.22|
Structure:
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