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Target
Peptidyl-prolyl cis-trans isomerase FKBP5
Ligand
BDBM7882
Substrate
n/a
Meas. Tech.
ChEMBL_1973798 (CHEMBL4606616)
Kd
4400000±n/a nM
Citation
 Draxler, SW; Bauer, M; Eickmeier, C; Nadal, S; Nar, H; Rangel Rojas, D; Seeliger, D; Zeeb, M; Fiegen, D Hybrid Screening Approach for Very Small Fragments: X-ray and Computational Screening on FKBP51. J Med Chem 63:5856-5864 (2020) [PubMed]  Article 
Target
Name:
Peptidyl-prolyl cis-trans isomerase FKBP5
Synonyms:
51 kDa FK506-binding protein | 51 kDa FKBP | 54 kDa progesterone receptor-associated immunophilin | Androgen-regulated protein 6 | FF1 antigen | FK506-binding protein 5 | FKBP-5 | FKBP-51 | FKBP54 | HSP90-binding immunophilin | PPIase FKBP5 | Rotamase | p54 | FKBP5_HUMAN | FKBP5 | AIG6 | FKBP51
Type:
PROTEIN
Mol. Mass.:
51207.06
Organism:
Human
Description:
ChEMBL_952910
Residue:
457
Sequence:
MTTDEGAKNNEESPTATVAEQGEDITSKKDRGVLKIVKRVGNGEETPMIGDKVYVHYKGKLSNGKKFDSSHDRNEPFVFSLGKGQVIKAWDIGVATMKKGEICHLLCKPEYAYGSAGSLPKIPSNATLFFEIELLDFKGEDLFEDGGIIRRTKRKGEGYSNPNEGATVEIHLEGRCGGRMFDCRDVAFTVGEGEDHDIPIGIDKALEKMQREEQCILYLGPRYGFGEAGKPKFGIEPNAELIYEVTLKSFEKAKESWEMDTKEKLEQAAIVKEKGTVYFKGGKYMQAVIQYGKIVSWLEMEYGLSEKESKASESFLLAAFLNLAMCYLKLREYTKAVECCDKALGLDSANEKGLYRRGEAQLLMNEFESAKGDFEKVLEVNPQNKAARLQISMCQKKAKEHNERDRRIYANMFKKFAEQDAKEEANKAMGKKTSEGVTNEKGTDSQAMEEEKPEGHV
  
Inhibitor
Name:
BDBM7882
Synonyms:
CHEMBL540 | 1H-imidazole | imidazole | Imidazole (Im) | US9138393, Imidazole | US9144538, Imidazole
Type:
Small organic molecule
Emp. Form.:
C3H4N2
Mol. Mass.:
68.04
SMILES:
c1c[nH]cn1
Structure:
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