BDBM50113080 1-(Toluene-4-sulfonyl)-piperidine-2-carboxylic acid 3-(4-fluoro-phenyl)-propyl ester::CHEMBL416590

SMILES: Cc1ccc(cc1)S(=O)(=O)N1CCCCC1C(=O)OCCCc1ccc(F)cc1

InChI Key: InChIKey=DSLWSJZWVSGFQM-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50113080   

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
Peptidyl-prolyl cis-trans isomerase FKBP1A (Homo sapiens (Human))	BDBM50113080 (1-(Toluene-4-sulfonyl)-piperidine-2-carboxylic aci...) Show SMILES Cc1ccc(cc1)S(=O)(=O)N1CCCCC1C(=O)OCCCc1ccc(F)cc1 Show InChI InChI=1S/C22H26FNO4S/c1-17-7-13-20(14-8-17)29(26,27)24-15-3-2-6-21(24)22(25)28-16-4-5-18-9-11-19(23)12-10-18/h7-14,21H,2-6,15-16H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Guilford Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of peptidyl-prolyl isomerase (PPIase, or rotamase) activity of FK506 binding protein 12				Bioorg Med Chem Lett 12: 1421-8 (2002) BindingDB Entry DOI: 10.7270/Q279441H
					More data for this Ligand-Target Pair