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SMILES: Oc1ccc(\C=c2/sc3nc4ccccc4n3c2=O)cc1O

InChI Key: InChIKey=PZIZLKJGPGUSCJ-ZSOIEALJSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50391711   

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
Protein-tyrosine-phosphatase (Homo sapiens (Human))	BDBM50391711 (CHEMBL2146958) Show SMILES Oc1ccc(\C=c2/sc3nc4ccccc4n3c2=O)cc1O Show InChI InChI=1S/C16H10N2O3S/c19-12-6-5-9(7-13(12)20)8-14-15(21)18-11-4-2-1-3-10(11)17-16(18)22-14/h1-8,19-20H/b14-8-	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Sejong University Curated by ChEMBL					Assay Description Inhibition of His-tagged PTPsigma catalytic domain amino acid 1369 to 1948 using DiFMUP as substrate after 20 mins by spectrofluorometric analysis				Bioorg Med Chem Lett 22: 6333-7 (2012) Article DOI: 10.1016/j.bmcl.2012.08.081 BindingDB Entry DOI: 10.7270/Q2HT2QDC
					More data for this Ligand-Target Pair
Protein tyrosine phosphatase type IVA 1 (Homo sapiens (Human))	BDBM50391711 (CHEMBL2146958) Show SMILES Oc1ccc(\C=c2/sc3nc4ccccc4n3c2=O)cc1O Show InChI InChI=1S/C16H10N2O3S/c19-12-6-5-9(7-13(12)20)8-14-15(21)18-11-4-2-1-3-10(11)17-16(18)22-14/h1-8,19-20H/b14-8-	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sejong University Curated by ChEMBL					Assay Description Inhibition of PRL1				Bioorg Med Chem Lett 22: 6333-7 (2012) Article DOI: 10.1016/j.bmcl.2012.08.081 BindingDB Entry DOI: 10.7270/Q2HT2QDC
					More data for this Ligand-Target Pair
Co-chaperonin GroES (Escherichia coli)	BDBM50391711 (CHEMBL2146958) Show SMILES Oc1ccc(\C=c2/sc3nc4ccccc4n3c2=O)cc1O Show InChI InChI=1S/C16H10N2O3S/c19-12-6-5-9(7-13(12)20)8-14-15(21)18-11-4-2-1-3-10(11)17-16(18)22-14/h1-8,19-20H/b14-8-	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli GroEL/GroES expressed in Escherichia coli DH5alpha/BL21 (DE3) assessed as inhibition of denatured MDH refolding preinc...				Bioorg Med Chem Lett 24: 786-9 (2014) Article DOI: 10.1016/j.bmcl.2013.12.100 BindingDB Entry DOI: 10.7270/Q27D2Z3M
					More data for this Ligand-Target Pair
Protein tyrosine phosphatase type IVA 3 (Homo sapiens (Human))	BDBM50391711 (CHEMBL2146958) Show SMILES Oc1ccc(\C=c2/sc3nc4ccccc4n3c2=O)cc1O Show InChI InChI=1S/C16H10N2O3S/c19-12-6-5-9(7-13(12)20)8-14-15(21)18-11-4-2-1-3-10(11)17-16(18)22-14/h1-8,19-20H/b14-8-	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sejong University Curated by ChEMBL					Assay Description Inhibition of PRL3				Bioorg Med Chem Lett 22: 6333-7 (2012) Article DOI: 10.1016/j.bmcl.2012.08.081 BindingDB Entry DOI: 10.7270/Q2HT2QDC
					More data for this Ligand-Target Pair
Co-chaperonin GroES (Escherichia coli)	BDBM50391711 (CHEMBL2146958) Show SMILES Oc1ccc(\C=c2/sc3nc4ccccc4n3c2=O)cc1O Show InChI InChI=1S/C16H10N2O3S/c19-12-6-5-9(7-13(12)20)8-14-15(21)18-11-4-2-1-3-10(11)17-16(18)22-14/h1-8,19-20H/b14-8-	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli GroEL/GroES-ATPase activity expressed in Escherichia coli DH5alpha/BL21 (DE3) assessed as inhibition of denatured MDH ...				Bioorg Med Chem Lett 24: 786-9 (2014) Article DOI: 10.1016/j.bmcl.2013.12.100 BindingDB Entry DOI: 10.7270/Q27D2Z3M
					More data for this Ligand-Target Pair
Dual specificity protein phosphatase 4 (Homo sapiens (Human))	BDBM50391711 (CHEMBL2146958) Show SMILES Oc1ccc(\C=c2/sc3nc4ccccc4n3c2=O)cc1O Show InChI InChI=1S/C16H10N2O3S/c19-12-6-5-9(7-13(12)20)8-14-15(21)18-11-4-2-1-3-10(11)17-16(18)22-14/h1-8,19-20H/b14-8-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Sejong University Curated by ChEMBL					Assay Description Inhibition of MKP2				Bioorg Med Chem Lett 22: 6333-7 (2012) Article DOI: 10.1016/j.bmcl.2012.08.081 BindingDB Entry DOI: 10.7270/Q2HT2QDC
					More data for this Ligand-Target Pair