BDBM50123297 2-Allyl-6,8-dimethoxy-1-thioxo-1,2-dihydro-imidazo[1,5-a]indol-3-one::CHEMBL345772

SMILES: COc1cc(OC)c2cc3C(=S)N(CC=C)C(=O)n3c2c1

InChI Key: InChIKey=CERRBONJGKDYCU-UHFFFAOYSA-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 = 50123297   

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
Tumor necrosis factor receptor R1 (Homo sapiens (Human))	BDBM50123297 (2-Allyl-6,8-dimethoxy-1-thioxo-1,2-dihydro-imidazo...) Show SMILES COc1cc(OC)c2cc3C(=S)N(CC=C)C(=O)n3c2c1 Show InChI InChI=1S/C15H14N2O3S/c1-4-5-16-14(21)12-8-10-11(17(12)15(16)18)6-9(19-2)7-13(10)20-3/h4,6-8H,1,5H2,2-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of TNF-alpha binding to TNFRc1				Bioorg Med Chem Lett 13: 533-8 (2003) BindingDB Entry DOI: 10.7270/Q2X929N3
					More data for this Ligand-Target Pair