BDBM50037078 2-(Phenyl)-isothiazolo[5,4-b]pyridin-3(2H)-one::2-Phenyl-isothiazolo[5,4-b]pyridin-3-one::CHEMBL316658::TCMDC-125874::cid_5703

SMILES: O=c1n(sc2ncccc12)-c1ccccc1

InChI Key: InChIKey=LUMATLSEPMKELP-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50037078   

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
glucose-6-phosphate dehydrogenase (Leuconostoc mesenteroides)	BDBM50037078 (2-(Phenyl)-isothiazolo[5,4-b]pyridin-3(2H)-one | 2...) Show SMILES O=c1n(sc2ncccc12)-c1ccccc1 Show InChI InChI=1S/C12H8N2OS/c15-12-10-7-4-8-13-11(10)16-14(12)9-5-2-1-3-6-9/h1-8H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Pittsburgh Molecular Library Screening Center Curated by PubChem BioAssay					Assay Description Excerpt from MH082340 application (Dr. James Morris, Clemson University) Trypanosoma brucei, the digenic protozoan parasite that causes African sleep...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2C53J9J
					More data for this Ligand-Target Pair
hexokinase (Trypanosoma brucei)	BDBM50037078 (2-(Phenyl)-isothiazolo[5,4-b]pyridin-3(2H)-one | 2...) Show SMILES O=c1n(sc2ncccc12)-c1ccccc1 Show InChI InChI=1S/C12H8N2OS/c15-12-10-7-4-8-13-11(10)16-14(12)9-5-2-1-3-6-9/h1-8H	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.27E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Pittsburgh Molecular Library Screening Center Curated by PubChem BioAssay					Assay Description Excerpt from MH0882340 application (Dr. James Morris, Clemson University) Trypanosoma brucei, the digenic protozoan parasite that causes African slee...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q21834XK
					More data for this Ligand-Target Pair
Histone acetyltransferase PCAF (Homo sapiens (Human))	BDBM50037078 (2-(Phenyl)-isothiazolo[5,4-b]pyridin-3(2H)-one | 2...) Show SMILES O=c1n(sc2ncccc12)-c1ccccc1 Show InChI InChI=1S/C12H8N2OS/c15-12-10-7-4-8-13-11(10)16-14(12)9-5-2-1-3-6-9/h1-8H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Cancer Research Curated by ChEMBL					Assay Description Inhibition of GST-fused recombinant HAT PCAF expressed in Escherichia coli by filter assay				Bioorg Med Chem 17: 467-74 (2009) Article DOI: 10.1016/j.bmc.2008.11.079 BindingDB Entry DOI: 10.7270/Q2H70GRB
					More data for this Ligand-Target Pair
Histone acetyltransferase PCAF (Homo sapiens (Human))	BDBM50037078 (2-(Phenyl)-isothiazolo[5,4-b]pyridin-3(2H)-one | 2...) Show SMILES O=c1n(sc2ncccc12)-c1ccccc1 Show InChI InChI=1S/C12H8N2OS/c15-12-10-7-4-8-13-11(10)16-14(12)9-5-2-1-3-6-9/h1-8H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.85E+3	n/a	n/a	n/a	n/a	n/a	n/a
Albert-Ludwigs-University of Freiburg Curated by ChEMBL					Assay Description Inhibition of histone acetylase activity of human recombinant PCAF expressed in Escherichia coli using biotinylated oligopeptide sequences from histo...				Bioorg Med Chem 19: 3678-89 (2011) Article DOI: 10.1016/j.bmc.2011.01.063 BindingDB Entry DOI: 10.7270/Q2NV9JKS
					More data for this Ligand-Target Pair
Potassium-transporting ATPase (Sus scrofa (Pig))	BDBM50037078 (2-(Phenyl)-isothiazolo[5,4-b]pyridin-3(2H)-one | 2...) Show SMILES O=c1n(sc2ncccc12)-c1ccccc1 Show InChI InChI=1S/C12H8N2OS/c15-12-10-7-4-8-13-11(10)16-14(12)9-5-2-1-3-6-9/h1-8H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Dainippon Pharmaceutical Company, Ltd. Curated by ChEMBL					Assay Description Inhibition of porcine gastric H+/K+ ATPase				J Med Chem 40: 313-21 (1997) Article DOI: 10.1021/jm9605593 BindingDB Entry DOI: 10.7270/Q2445KKS
					More data for this Ligand-Target Pair