BDBM50098919 (R)-1-Isopropyl-4-(4-methoxy-benzenesulfonyl)-7-oxo-[1,4]diazepane-5-carboxylic acid hydroxyamide::CHEMBL7756

SMILES: COc1ccc(cc1)S(=O)(=O)N1CCN(C(C)C)C(=O)C[C@@H]1C(=O)NO

InChI Key: InChIKey=HTNLSTWGHBHDPS-CQSZACIVSA-N

Data: 7 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 7 hits for monomerid = 50098919   

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 13 (Rattus norvegicus)	BDBM50098919 ((R)-1-Isopropyl-4-(4-methoxy-benzenesulfonyl)-7-ox...) Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(C(C)C)C(=O)C[C@@H]1C(=O)NO Show InChI InChI=1S/C16H23N3O6S/c1-11(2)18-8-9-19(14(10-15(18)20)16(21)17-22)26(23,24)13-6-4-12(25-3)5-7-13/h4-7,11,14,22H,8-10H2,1-3H3,(H,17,21)/t14-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
Procter and Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of Matrix metalloprotease-13				Bioorg Med Chem Lett 11: 1009-13 (2001) BindingDB Entry DOI: 10.7270/Q2X34Z04
					More data for this Ligand-Target Pair
Neutrophil collagenase (Homo sapiens (Human))	BDBM50098919 ((R)-1-Isopropyl-4-(4-methoxy-benzenesulfonyl)-7-ox...) Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(C(C)C)C(=O)C[C@@H]1C(=O)NO Show InChI InChI=1S/C16H23N3O6S/c1-11(2)18-8-9-19(14(10-15(18)20)16(21)17-22)26(23,24)13-6-4-12(25-3)5-7-13/h4-7,11,14,22H,8-10H2,1-3H3,(H,17,21)/t14-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.70	n/a	n/a	n/a	n/a	n/a	n/a
Procter and Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of Matrix metalloprotease-8				Bioorg Med Chem Lett 11: 1009-13 (2001) BindingDB Entry DOI: 10.7270/Q2X34Z04
					More data for this Ligand-Target Pair
Matrix metalloproteinase-7 (MMP7) (Homo sapiens (Human))	BDBM50098919 ((R)-1-Isopropyl-4-(4-methoxy-benzenesulfonyl)-7-ox...) Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(C(C)C)C(=O)C[C@@H]1C(=O)NO Show InChI InChI=1S/C16H23N3O6S/c1-11(2)18-8-9-19(14(10-15(18)20)16(21)17-22)26(23,24)13-6-4-12(25-3)5-7-13/h4-7,11,14,22H,8-10H2,1-3H3,(H,17,21)/t14-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	369	n/a	n/a	n/a	n/a	n/a	n/a
Procter and Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of Matrix metalloprotease-7				Bioorg Med Chem Lett 11: 1009-13 (2001) BindingDB Entry DOI: 10.7270/Q2X34Z04
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50098919 ((R)-1-Isopropyl-4-(4-methoxy-benzenesulfonyl)-7-ox...) Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(C(C)C)C(=O)C[C@@H]1C(=O)NO Show InChI InChI=1S/C16H23N3O6S/c1-11(2)18-8-9-19(14(10-15(18)20)16(21)17-22)26(23,24)13-6-4-12(25-3)5-7-13/h4-7,11,14,22H,8-10H2,1-3H3,(H,17,21)/t14-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Procter and Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of human Matrix metalloprotease-1				Bioorg Med Chem Lett 11: 1009-13 (2001) BindingDB Entry DOI: 10.7270/Q2X34Z04
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50098919 ((R)-1-Isopropyl-4-(4-methoxy-benzenesulfonyl)-7-ox...) Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(C(C)C)C(=O)C[C@@H]1C(=O)NO Show InChI InChI=1S/C16H23N3O6S/c1-11(2)18-8-9-19(14(10-15(18)20)16(21)17-22)26(23,24)13-6-4-12(25-3)5-7-13/h4-7,11,14,22H,8-10H2,1-3H3,(H,17,21)/t14-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.5	n/a	n/a	n/a	n/a	n/a	n/a
Procter and Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of Matrix metalloprotease-3				Bioorg Med Chem Lett 11: 1009-13 (2001) BindingDB Entry DOI: 10.7270/Q2X34Z04
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50098919 ((R)-1-Isopropyl-4-(4-methoxy-benzenesulfonyl)-7-ox...) Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(C(C)C)C(=O)C[C@@H]1C(=O)NO Show InChI InChI=1S/C16H23N3O6S/c1-11(2)18-8-9-19(14(10-15(18)20)16(21)17-22)26(23,24)13-6-4-12(25-3)5-7-13/h4-7,11,14,22H,8-10H2,1-3H3,(H,17,21)/t14-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.10	n/a	n/a	n/a	n/a	n/a	n/a
Procter and Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of Matrix metalloprotease-9				Bioorg Med Chem Lett 11: 1009-13 (2001) BindingDB Entry DOI: 10.7270/Q2X34Z04
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50098919 ((R)-1-Isopropyl-4-(4-methoxy-benzenesulfonyl)-7-ox...) Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(C(C)C)C(=O)C[C@@H]1C(=O)NO Show InChI InChI=1S/C16H23N3O6S/c1-11(2)18-8-9-19(14(10-15(18)20)16(21)17-22)26(23,24)13-6-4-12(25-3)5-7-13/h4-7,11,14,22H,8-10H2,1-3H3,(H,17,21)/t14-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
Procter and Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of human Matrix metalloprotease-2				Bioorg Med Chem Lett 11: 1009-13 (2001) BindingDB Entry DOI: 10.7270/Q2X34Z04
					More data for this Ligand-Target Pair