BDBM50505854 CHEMBL4458109

SMILES: OC(=O)c1ccc(\C=C2/SC(=S)N(Cc3cccc(c3)C(F)(F)F)C2=S)cc1

InChI Key: InChIKey=PASWUUGFZJSQDJ-DHDCSXOGSA-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 = 50505854   

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
NACHT, LRR and PYD domains-containing protein 3 (Mus musculus)	BDBM50505854 (CHEMBL4458109) Show SMILES OC(=O)c1ccc(\C=C2/SC(=S)N(Cc3cccc(c3)C(F)(F)F)C2=S)cc1 Show InChI InChI=1S/C19H12F3NO2S3/c20-19(21,22)14-3-1-2-12(8-14)10-23-16(26)15(28-18(23)27)9-11-4-6-13(7-5-11)17(24)25/h1-9H,10H2,(H,24,25)/b15-9-	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of NLRP3 inflammasome activation in LPS-primed mouse bone marrow derived macrophages incubated for 30 mins by immunoblotting analysis				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111822
					More data for this Ligand-Target Pair