BDBM41961 4,5,6,7-tetrachloro-3',4',5',6'-tetrahydroxy-1-spiro[isobenzofuran-3,9'-xanthene]one::4,5,6,7-tetrachloro-3',4',5',6'-tetrahydroxy-spiro[phthalan-3,9'-xanthene]-1-one::4,5,6,7-tetrachloro-3',4',5',6'-tetrahydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one::4,5,6,7-tetrakis(chloranyl)-3',4',5',6'-tetrakis(oxidanyl)spiro[2-benzofuran-3,9'-xanthene]-1-one::TG2-222-2::cid_405765

SMILES: Oc1ccc2c(Oc3c(O)c(O)ccc3C22OC(=O)c3c2c(Cl)c(Cl)c(Cl)c3Cl)c1O

InChI Key: InChIKey=ZRFAUKPFBLJSPA-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 = 41961   

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
Mothers against decapentaplegic homolog 3 (Homo sapiens (Human))	BDBM41961 (4,5,6,7-tetrachloro-3',4',5',6'-tetrahydroxy-1-spi...) Show SMILES Oc1ccc2c(Oc3c(O)c(O)ccc3C22OC(=O)c3c2c(Cl)c(Cl)c(Cl)c3Cl)c1O Show InChI InChI=1S/C20H8Cl4O7/c21-11-9-10(12(22)14(24)13(11)23)20(31-19(9)29)5-1-3-7(25)15(27)17(5)30-18-6(20)2-4-8(26)16(18)28/h1-4,25-28H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: F.M. Hoffmann, University ...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q21R6NZ6
					More data for this Ligand-Target Pair