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Target
Peptidyl-prolyl cis-trans isomerase FKBP1A
Ligand
BDBM597688
Substrate
n/a
Meas. Tech.
SPR Assay to Determine Binding Affinity to FKBP12
Kd
<0.3±n/a nM
Citation
 Kincaid, J MTORC1 modulators and uses thereof US Patent  US11603377 Publication Date 3/14/2023 
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:
BDBM597688
Synonyms:
US11603377, Compound 9
Type:
Small organic molecule
Emp. Form.:
C54H88N2O17S
Mol. Mass.:
1069.345
SMILES:
COCCOCCS(=O)(=O)N[C@H]1C[C@H]2CC[C@H](C)[C@](O)(O2)C(=O)C(=O)N(C)C(C)C(=O)OC(CC(=O)C(C)\C=C(C)\C(O)C(OC)C(=O)C(C)CC\C=C\C=C\C=C1/C)[C@H](C)C[C@@H]1CC[C@@H](OCCO)[C@@H](C1)OC |r,c:39,t:53,55,57|
Structure:
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