BDBM50501224 CHEMBL3908434

SMILES: FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C(F)(F)F)ccc2o1

InChI Key: InChIKey=RMPODXYECPUGCS-UHFFFAOYSA-N

Data: 8 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 8 hits for monomerid = 50501224   

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
HSP60/HSP10 (Homo sapiens)	BDBM50501224 (CHEMBL3908434) Show SMILES FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C(F)(F)F)ccc2o1 Show InChI InChI=1S/C27H17F6N3O5S2/c28-26(29,30)17-3-10-21(11-4-17)42(37,38)35-19-7-1-16(2-8-19)25-34-23-15-20(9-14-24(23)41-25)36-43(39,40)22-12-5-18(6-13-22)27(31,32)33/h1-15,35-36H	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of human mitochondrial HSP60/HSP10 expressed in Escherichia coli DH5alpha/BL21 (DE3) assessed as inhibition of denatured MDH refolding pre...				Bioorg Med Chem Lett 26: 5247-5253 (2016) Article DOI: 10.1016/j.bmcl.2016.09.051 BindingDB Entry DOI: 10.7270/Q2WW7MRM
					More data for this Ligand-Target Pair
HSP60/HSP10 (Homo sapiens)	BDBM50501224 (CHEMBL3908434) Show SMILES FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C(F)(F)F)ccc2o1 Show InChI InChI=1S/C27H17F6N3O5S2/c28-26(29,30)17-3-10-21(11-4-17)42(37,38)35-19-7-1-16(2-8-19)25-34-23-15-20(9-14-24(23)41-25)36-43(39,40)22-12-5-18(6-13-22)27(31,32)33/h1-15,35-36H	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of human mitochondrial HSP60/HSP10-ATPase activity expressed in Escherichia coli DH5alpha/BL21 (DE3) assessed as inhibition of denatured M...				Bioorg Med Chem Lett 26: 5247-5253 (2016) Article DOI: 10.1016/j.bmcl.2016.09.051 BindingDB Entry DOI: 10.7270/Q2WW7MRM
					More data for this Ligand-Target Pair
10 kDa chaperonin (Escherichia coli)	BDBM50501224 (CHEMBL3908434) Show SMILES FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C(F)(F)F)ccc2o1 Show InChI InChI=1S/C27H17F6N3O5S2/c28-26(29,30)17-3-10-21(11-4-17)42(37,38)35-19-7-1-16(2-8-19)25-34-23-15-20(9-14-24(23)41-25)36-43(39,40)22-12-5-18(6-13-22)27(31,32)33/h1-15,35-36H	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>2.50E+5	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 26: 5247-5253 (2016) Article DOI: 10.1016/j.bmcl.2016.09.051 BindingDB Entry DOI: 10.7270/Q2WW7MRM
					More data for this Ligand-Target Pair
T-cell protein-tyrosine phosphatase (Homo sapiens (Human))	BDBM50501224 (CHEMBL3908434) Show SMILES FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C(F)(F)F)ccc2o1 Show InChI InChI=1S/C27H17F6N3O5S2/c28-26(29,30)17-3-10-21(11-4-17)42(37,38)35-19-7-1-16(2-8-19)25-34-23-15-20(9-14-24(23)41-25)36-43(39,40)22-12-5-18(6-13-22)27(31,32)33/h1-15,35-36H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human PTPN2 expressed in Escherichia coli Rosetta 2 (DE3) using pNPP as substrate after 45 mins by spectrophotometric method				Bioorg Med Chem Lett 29: 1665-1672 (2019) Article DOI: 10.1016/j.bmcl.2019.04.034
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 5 (Homo sapiens (Human))	BDBM50501224 (CHEMBL3908434) Show SMILES FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C(F)(F)F)ccc2o1 Show InChI InChI=1S/C27H17F6N3O5S2/c28-26(29,30)17-3-10-21(11-4-17)42(37,38)35-19-7-1-16(2-8-19)25-34-23-15-20(9-14-24(23)41-25)36-43(39,40)22-12-5-18(6-13-22)27(31,32)33/h1-15,35-36H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human PTPN5 expressed in Escherichia coli Rosetta 2 (DE3) using pNPP as substrate after 45 mins by spectrophotometric method				Bioorg Med Chem Lett 29: 1665-1672 (2019) Article DOI: 10.1016/j.bmcl.2019.04.034
					More data for this Ligand-Target Pair
Phosphotyrosine protein phosphatase (Mycobacterium tuberculosis)	BDBM50501224 (CHEMBL3908434) Show SMILES FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C(F)(F)F)ccc2o1 Show InChI InChI=1S/C27H17F6N3O5S2/c28-26(29,30)17-3-10-21(11-4-17)42(37,38)35-19-7-1-16(2-8-19)25-34-23-15-20(9-14-24(23)41-25)36-43(39,40)22-12-5-18(6-13-22)27(31,32)33/h1-15,35-36H	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University School of Medicine Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis His-tagged PtpB expressed in Escherichia coli Rosetta 2 (DE3) using pNPP as substrate after 30 mins by spect...				Bioorg Med Chem Lett 29: 1665-1672 (2019) Article DOI: 10.1016/j.bmcl.2019.04.034
					More data for this Ligand-Target Pair
Protein-tyrosine phosphatase 1B (Homo sapiens (Human))	BDBM50501224 (CHEMBL3908434) Show SMILES FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C(F)(F)F)ccc2o1 Show InChI InChI=1S/C27H17F6N3O5S2/c28-26(29,30)17-3-10-21(11-4-17)42(37,38)35-19-7-1-16(2-8-19)25-34-23-15-20(9-14-24(23)41-25)36-43(39,40)22-12-5-18(6-13-22)27(31,32)33/h1-15,35-36H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University School of Medicine Curated by ChEMBL					Assay Description Inhibition of human PTPN1 expressed in Escherichia coli Rosetta 2 (DE3) using pNPP as substrate after 45 mins by spectrophotometric method				Bioorg Med Chem Lett 29: 1665-1672 (2019) Article DOI: 10.1016/j.bmcl.2019.04.034
					More data for this Ligand-Target Pair
10 kDa chaperonin (Escherichia coli)	BDBM50501224 (CHEMBL3908434) Show SMILES FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C(F)(F)F)ccc2o1 Show InChI InChI=1S/C27H17F6N3O5S2/c28-26(29,30)17-3-10-21(11-4-17)42(37,38)35-19-7-1-16(2-8-19)25-34-23-15-20(9-14-24(23)41-25)36-43(39,40)22-12-5-18(6-13-22)27(31,32)33/h1-15,35-36H	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.50E+4	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 26: 5247-5253 (2016) Article DOI: 10.1016/j.bmcl.2016.09.051 BindingDB Entry DOI: 10.7270/Q2WW7MRM
					More data for this Ligand-Target Pair