BDBM50170293 (S)-2-(4'-{[4-(1-Carboxy-ethoxy)-benzofuran-2-carbonyl]-amino}-biphenyl-4-sulfonylamino)-3-methyl-butyric acid::CHEMBL191106

SMILES: CC(C)[C@H](NS(=O)(=O)c1ccc(cc1)-c1ccc(NC(=O)c2cc3c(OC(C)C(O)=O)cccc3o2)cc1)C(O)=O

InChI Key: InChIKey=BRRSHCMZHWWBNJ-KKFPZRRJSA-N

Data: 3 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 3 hits for monomerid = 50170293   

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-14 (MMP14) (Homo sapiens (Human))	BDBM50170293 ((S)-2-(4'-{[4-(1-Carboxy-ethoxy)-benzofuran-2-carb...) Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc(cc1)-c1ccc(NC(=O)c2cc3c(OC(C)C(O)=O)cccc3o2)cc1)C(O)=O Show InChI InChI=1S/C29H28N2O9S/c1-16(2)26(29(35)36)31-41(37,38)21-13-9-19(10-14-21)18-7-11-20(12-8-18)30-27(32)25-15-22-23(39-17(3)28(33)34)5-4-6-24(22)40-25/h4-17,26,31H,1-3H3,(H,30,32)(H,33,34)(H,35,36)/t17?,26-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibitory concentration against MMP-14				Bioorg Med Chem Lett 15: 4105-9 (2005) Article DOI: 10.1016/j.bmcl.2005.06.019 BindingDB Entry DOI: 10.7270/Q2TX3DXK
					More data for this Ligand-Target Pair
Matrix metalloproteinase 13 (Bos taurus)	BDBM50170293 ((S)-2-(4'-{[4-(1-Carboxy-ethoxy)-benzofuran-2-carb...) Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc(cc1)-c1ccc(NC(=O)c2cc3c(OC(C)C(O)=O)cccc3o2)cc1)C(O)=O Show InChI InChI=1S/C29H28N2O9S/c1-16(2)26(29(35)36)31-41(37,38)21-13-9-19(10-14-21)18-7-11-20(12-8-18)30-27(32)25-15-22-23(39-17(3)28(33)34)5-4-6-24(22)40-25/h4-17,26,31H,1-3H3,(H,30,32)(H,33,34)(H,35,36)/t17?,26-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibitory concentration against MMP-13 of bovine articular cartilage explants				Bioorg Med Chem Lett 15: 4105-9 (2005) Article DOI: 10.1016/j.bmcl.2005.06.019 BindingDB Entry DOI: 10.7270/Q2TX3DXK
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50170293 ((S)-2-(4'-{[4-(1-Carboxy-ethoxy)-benzofuran-2-carb...) Show SMILES CC(C)[C@H](NS(=O)(=O)c1ccc(cc1)-c1ccc(NC(=O)c2cc3c(OC(C)C(O)=O)cccc3o2)cc1)C(O)=O Show InChI InChI=1S/C29H28N2O9S/c1-16(2)26(29(35)36)31-41(37,38)21-13-9-19(10-14-21)18-7-11-20(12-8-18)30-27(32)25-15-22-23(39-17(3)28(33)34)5-4-6-24(22)40-25/h4-17,26,31H,1-3H3,(H,30,32)(H,33,34)(H,35,36)/t17?,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.59E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibitory concentration against MMP-2				Bioorg Med Chem Lett 15: 4105-9 (2005) Article DOI: 10.1016/j.bmcl.2005.06.019 BindingDB Entry DOI: 10.7270/Q2TX3DXK
					More data for this Ligand-Target Pair