BDBM114645 1-[2-(dimethylamino)ethylamino]-4-methyl-7-oxidanyl-thioxanthen-9-one::1-[2-(dimethylamino)ethylamino]-7-hydroxy-4-methyl-9-thioxanthenone::1-[2-(dimethylamino)ethylamino]-7-hydroxy-4-methyl-thioxanthen-9-one::1-[2-(dimethylamino)ethylamino]-7-hydroxy-4-methylthioxanthen-9-one::MLS002701807::SMR001565401::cid_432873

SMILES: CN(C)CCNc1ccc(C)c2sc3ccc(O)cc3c(=O)c12

InChI Key: InChIKey=IJIQUDQBKAXAML-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 = 114645   

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
Methyl-CpG binding domain protein 2 (Homo sapiens (Human))	BDBM114645 (1-[2-(dimethylamino)ethylamino]-4-methyl-7-oxidany...) Show SMILES CN(C)CCNc1ccc(C)c2sc3ccc(O)cc3c(=O)c12 Show InChI InChI=1S/C18H20N2O2S/c1-11-4-6-14(19-8-9-20(2)3)16-17(22)13-10-12(21)5-7-15(13)23-18(11)16/h4-7,10,19,21H,8-9H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	9.44E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...				PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q20K2778
					More data for this Ligand-Target Pair