BDBM50136744 CHEMBL3753761

SMILES: OC[C@@H]1CC[C@@H](N1S(=O)(=O)c1cccnc1)c1ccc(F)cc1

InChI Key: InChIKey=WRUWPUSRYHZVSB-GOEBONIOSA-N

Data: 1 IC50

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 = 50136744   

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
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50136744 (CHEMBL3753761) Show SMILES OC[C@@H]1CC[C@@H](N1S(=O)(=O)c1cccnc1)c1ccc(F)cc1 |r| Show InChI InChI=1S/C16H17FN2O3S/c17-13-5-3-12(4-6-13)16-8-7-14(11-20)19(16)23(21,22)15-2-1-9-18-10-15/h1-6,9-10,14,16,20H,7-8,11H2/t14-,16+/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Inhibition of human TRPA1				Bioorg Med Chem Lett 26: 495-8 (2016) BindingDB Entry DOI: 10.7270/Q23R0VRB
					More data for this Ligand-Target Pair