BDBM50096480 4-[Benzyl-(4-methoxy-benzenesulfonyl)-amino]-5-bromo-thiophene-3-carboxylic acid hydroxyamide::CHEMBL78826

SMILES: COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1c(Br)scc1C(=O)NO

InChI Key: InChIKey=QCBWOUQUDIILOW-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50096480   

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
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50096480 (4-[Benzyl-(4-methoxy-benzenesulfonyl)-amino]-5-bro...) Show SMILES COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1c(Br)scc1C(=O)NO Show InChI InChI=1S/C19H17BrN2O5S2/c1-27-14-7-9-15(10-8-14)29(25,26)22(11-13-5-3-2-4-6-13)17-16(19(23)21-24)12-28-18(17)20/h2-10,12,24H,11H2,1H3,(H,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	236	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth-Ayerst Research Curated by ChEMBL					Assay Description Inhibition of Matrix metalloprotease-9				Bioorg Med Chem Lett 11: 239-42 (2001) BindingDB Entry DOI: 10.7270/Q2PR7WHJ
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50096480 (4-[Benzyl-(4-methoxy-benzenesulfonyl)-amino]-5-bro...) Show SMILES COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1c(Br)scc1C(=O)NO Show InChI InChI=1S/C19H17BrN2O5S2/c1-27-14-7-9-15(10-8-14)29(25,26)22(11-13-5-3-2-4-6-13)17-16(19(23)21-24)12-28-18(17)20/h2-10,12,24H,11H2,1H3,(H,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	639	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth-Ayerst Research Curated by ChEMBL					Assay Description Inhibition of Matrix metalloprotease-1				Bioorg Med Chem Lett 11: 239-42 (2001) BindingDB Entry DOI: 10.7270/Q2PR7WHJ
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50096480 (4-[Benzyl-(4-methoxy-benzenesulfonyl)-amino]-5-bro...) Show SMILES COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1c(Br)scc1C(=O)NO Show InChI InChI=1S/C19H17BrN2O5S2/c1-27-14-7-9-15(10-8-14)29(25,26)22(11-13-5-3-2-4-6-13)17-16(19(23)21-24)12-28-18(17)20/h2-10,12,24H,11H2,1H3,(H,21,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	427	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (BHU) Curated by ChEMBL					Assay Description Inhibition of MMP13 (unknown origin)				Eur J Med Chem 60: 89-100 (2013) Article DOI: 10.1016/j.ejmech.2012.10.016 BindingDB Entry DOI: 10.7270/Q2MC91CR
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50096480 (4-[Benzyl-(4-methoxy-benzenesulfonyl)-amino]-5-bro...) Show SMILES COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1c(Br)scc1C(=O)NO Show InChI InChI=1S/C19H17BrN2O5S2/c1-27-14-7-9-15(10-8-14)29(25,26)22(11-13-5-3-2-4-6-13)17-16(19(23)21-24)12-28-18(17)20/h2-10,12,24H,11H2,1H3,(H,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	639	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (BHU) Curated by ChEMBL					Assay Description Inhibition of MMP1 (unknown origin)				Eur J Med Chem 60: 89-100 (2013) Article DOI: 10.1016/j.ejmech.2012.10.016 BindingDB Entry DOI: 10.7270/Q2MC91CR
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50096480 (4-[Benzyl-(4-methoxy-benzenesulfonyl)-amino]-5-bro...) Show SMILES COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1c(Br)scc1C(=O)NO Show InChI InChI=1S/C19H17BrN2O5S2/c1-27-14-7-9-15(10-8-14)29(25,26)22(11-13-5-3-2-4-6-13)17-16(19(23)21-24)12-28-18(17)20/h2-10,12,24H,11H2,1H3,(H,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	236	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (BHU) Curated by ChEMBL					Assay Description Inhibition of MMP9 (unknown origin)				Eur J Med Chem 60: 89-100 (2013) Article DOI: 10.1016/j.ejmech.2012.10.016 BindingDB Entry DOI: 10.7270/Q2MC91CR
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50096480 (4-[Benzyl-(4-methoxy-benzenesulfonyl)-amino]-5-bro...) Show SMILES COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)c1c(Br)scc1C(=O)NO Show InChI InChI=1S/C19H17BrN2O5S2/c1-27-14-7-9-15(10-8-14)29(25,26)22(11-13-5-3-2-4-6-13)17-16(19(23)21-24)12-28-18(17)20/h2-10,12,24H,11H2,1H3,(H,21,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	427	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth-Ayerst Research Curated by ChEMBL					Assay Description Inhibition of Matrix metalloprotease-13				Bioorg Med Chem Lett 11: 239-42 (2001) BindingDB Entry DOI: 10.7270/Q2PR7WHJ
					More data for this Ligand-Target Pair