BDBM50123296 2-Allyl-6,8-dimethoxy-9-methyl-3-thioxo-2,3-dihydro-imidazo[1,5-a]indol-1-one::CHEMBL345771

SMILES: COc1cc(OC)c2c(c1)n1c(c(O)n(CC=C)c1=S)c2=C

InChI Key: InChIKey=APHRDYZUJZYZMN-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 = 50123296   

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))	BDBM50123296 (2-Allyl-6,8-dimethoxy-9-methyl-3-thioxo-2,3-dihydr...) Show SMILES COc1cc(OC)c2c(c1)n1c(c(O)n(CC=C)c1=S)c2=C Show InChI InChI=1S/C16H16N2O3S/c1-5-6-17-15(19)14-9(2)13-11(18(14)16(17)22)7-10(20-3)8-12(13)21-4/h5,7-8,19H,1-2,6H2,3-4H3	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	1.10E+3	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