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Target
Peptidyl-prolyl cis-trans isomerase FKBP1A
Ligand
BDBM50113094
Substrate
n/a
Meas. Tech.
ChEBML_66266
Ki
1000±n/a nM
Citation
 Choi, C; Li, JH; Vaal, M; Thomas, C; Limburg, D; Wu, YQ; Chen, Y; Soni, R; Scott, C; Ross, DT; Guo, H; Howorth, P; Valentine, H; Liang, S; Spicer, D; Fuller, M; Steiner, J; Hamilton, GS Use of parallel-synthesis combinatorial libraries for rapid identification of potent FKBP12 inhibitors. Bioorg Med Chem Lett 12:1421-8 (2002) [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:
BDBM50113094
Synonyms:
(S)-1-(Adamantan-1-ylcarbamoyl)-pyrrolidine-2-carboxylic acid 3-phenyl-propyl ester | CHEMBL287680
Type:
Small organic molecule
Emp. Form.:
C25H34N2O3
Mol. Mass.:
410.5491
SMILES:
O=C(OCCCc1ccccc1)[C@@H]1CCCN1C(=O)NC12C[C@H]3C[C@H](C[C@H](C3)C1)C2 |TLB:23:24:28:22.21.27,THB:23:22:28:24.29.25|
Structure:
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