BDBM50125257 CHEMBL3623623
SMILES: COc1ccc(CC[C@@H](OC(=O)[C@@H]2CCCCN2C(=O)[C@H]([C@@H](C)O)C2CCCCC2)c2cccc(OCCN3CCOCC3)c2)cc1OC
InChI Key: InChIKey=RUPZPRKPEAFHDB-JEPHQYQUSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
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Peptidyl-prolyl cis-trans isomerase FKBP5 (Homo sapiens (Human)) | BDBM50125257 (CHEMBL3623623) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid PDB UniChem Similars | PDB PubMed | 700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Max Planck Institute of Psychiatry Curated by ChEMBL | Assay Description Binding affinity to FKBP51 (unknown origin) by competitive fluorescence polarization assay | J Med Chem 58: 7796-806 (2015) BindingDB Entry DOI: 10.7270/Q25Q4XWR | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |