Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peptidyl-prolyl cis-trans isomerase FKBP1A' and Ligand = 'BDBM50403335'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Peptidyl-prolyl cis-trans isomerase FKBP1A (Homo sapiens (Human))	BDBM50403335 (CHEMBL325145) Show SMILES CC1(C)CCC(=O)CCCCC(=O)OCC(C)(C)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@@H]1CCc1ccccc1 Show InChI InChI=1S/C32H45NO7/c1-31(2)20-19-24(34)14-8-9-16-27(35)39-22-32(3,4)28(36)29(37)33-21-11-10-15-25(33)30(38)40-26(31)18-17-23-12-6-5-7-13-23/h5-7,12-13,25-26H,8-11,14-22H2,1-4H3/t25-,26+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibitory activity against FK506 binding protein 12 (FKBP12)				Bioorg Med Chem Lett 4: 325-328 (1994) Article DOI: 10.1016/S0960-894X(01)80137-2 BindingDB Entry DOI: 10.7270/Q21Z45M7
					More data for this Ligand-Target Pair