BDBM88730 MLS000574482::N-[5-(1H-benzimidazol-2-yl)-2-chloranyl-phenyl]-4-ethoxy-3-nitro-benzamide::N-[5-(1H-benzimidazol-2-yl)-2-chloro-phenyl]-4-ethoxy-3-nitro-benzamide::N-[5-(1H-benzimidazol-2-yl)-2-chlorophenyl]-4-ethoxy-3-nitrobenzamide::SMR000195146::cid_1338419

SMILES: CCOc1ccc(cc1[N+]([O-])=O)C(=O)Nc1cc(ccc1Cl)-c1nc2ccccc2[nH]1

InChI Key: InChIKey=XXEMVFHVLJSASR-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 = 88730   

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
tyrosine-protein phosphatase non-receptor type 5 isoform a (Homo sapiens (Human))	BDBM88730 (MLS000574482 | N-[5-(1H-benzimidazol-2-yl)-2-chlor...) Show SMILES CCOc1ccc(cc1[N+]([O-])=O)C(=O)Nc1cc(ccc1Cl)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C22H17ClN4O4/c1-2-31-20-10-8-14(12-19(20)27(29)30)22(28)26-18-11-13(7-9-15(18)23)21-24-16-5-3-4-6-17(16)25-21/h3-12H,2H2,1H3,(H,24,25)(H,26,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	6.73E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2DV1HGT
					More data for this Ligand-Target Pair
Dual specificity protein phosphatase (VHR) (Homo sapiens (Human))	BDBM88730 (MLS000574482 | N-[5-(1H-benzimidazol-2-yl)-2-chlor...) Show SMILES CCOc1ccc(cc1[N+]([O-])=O)C(=O)Nc1cc(ccc1Cl)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C22H17ClN4O4/c1-2-31-20-10-8-14(12-19(20)27(29)30)22(28)26-18-11-13(7-9-15(18)23)21-24-16-5-3-4-6-17(16)25-21/h3-12H,2H2,1H3,(H,24,25)(H,26,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.11E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2959G44
					More data for this Ligand-Target Pair
Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP (Homo sapiens (Human))	BDBM88730 (MLS000574482 | N-[5-(1H-benzimidazol-2-yl)-2-chlor...) Show SMILES CCOc1ccc(cc1[N+]([O-])=O)C(=O)Nc1cc(ccc1Cl)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C22H17ClN4O4/c1-2-31-20-10-8-14(12-19(20)27(29)30)22(28)26-18-11-13(7-9-15(18)23)21-24-16-5-3-4-6-17(16)25-21/h3-12H,2H2,1H3,(H,24,25)(H,26,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.99E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2FQ9V6B
					More data for this Ligand-Target Pair
tyrosine-protein phosphatase non-receptor type 5 isoform a (Homo sapiens (Human))	BDBM88730 (MLS000574482 | N-[5-(1H-benzimidazol-2-yl)-2-chlor...) Show SMILES CCOc1ccc(cc1[N+]([O-])=O)C(=O)Nc1cc(ccc1Cl)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C22H17ClN4O4/c1-2-31-20-10-8-14(12-19(20)27(29)30)22(28)26-18-11-13(7-9-15(18)23)21-24-16-5-3-4-6-17(16)25-21/h3-12H,2H2,1H3,(H,24,25)(H,26,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>8.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2KH0KWR
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 11 (Homo sapiens (Human))	BDBM88730 (MLS000574482 | N-[5-(1H-benzimidazol-2-yl)-2-chlor...) Show SMILES CCOc1ccc(cc1[N+]([O-])=O)C(=O)Nc1cc(ccc1Cl)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C22H17ClN4O4/c1-2-31-20-10-8-14(12-19(20)27(29)30)22(28)26-18-11-13(7-9-15(18)23)21-24-16-5-3-4-6-17(16)25-21/h3-12H,2H2,1H3,(H,24,25)(H,26,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2T43RPN
					More data for this Ligand-Target Pair