BDBM50084213 (R)-1-(4-Butoxy-benzenesulfonyl)-4-methoxyamino-pyrrolidine-2-carboxylic acid hydroxyamide::CHEMBL358182

SMILES: CCCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC

InChI Key: InChIKey=NIUQIJFMBOIHLA-WPZCJLIBSA-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 = 50084213   

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
Collagenase 3 (Homo sapiens (Human))	BDBM50084213 ((R)-1-(4-Butoxy-benzenesulfonyl)-4-methoxyamino-py...) Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC Show InChI InChI=1S/C16H25N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,12,15,18,21H,3-4,9-11H2,1-2H3,(H,17,20)/t12?,15-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description In vitro inhibition of human recombinant collagenase-3 (Matrix metalloproteinase-13)				J Med Chem 42: 5426-36 (2000) BindingDB Entry DOI: 10.7270/Q2Q23ZGT
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50084213 ((R)-1-(4-Butoxy-benzenesulfonyl)-4-methoxyamino-py...) Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC Show InChI InChI=1S/C16H25N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,12,15,18,21H,3-4,9-11H2,1-2H3,(H,17,20)/t12?,15-/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	21	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)				J Med Chem 42: 5426-36 (2000) BindingDB Entry DOI: 10.7270/Q2Q23ZGT
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50084213 ((R)-1-(4-Butoxy-benzenesulfonyl)-4-methoxyamino-py...) Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC Show InChI InChI=1S/C16H25N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,12,15,18,21H,3-4,9-11H2,1-2H3,(H,17,20)/t12?,15-/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	1	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description In vitro inhibitory activity against gelatinase-A (matrix metalloproteinase-2).				J Med Chem 42: 5426-36 (2000) BindingDB Entry DOI: 10.7270/Q2Q23ZGT
					More data for this Ligand-Target Pair
Matrix metalloproteinase-7 (MMP7) (Homo sapiens (Human))	BDBM50084213 ((R)-1-(4-Butoxy-benzenesulfonyl)-4-methoxyamino-py...) Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC Show InChI InChI=1S/C16H25N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,12,15,18,21H,3-4,9-11H2,1-2H3,(H,17,20)/t12?,15-/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	2.08E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description In vitro inhibition of matrilysin (Matrix metalloproteinase-7, MMP-7)				J Med Chem 42: 5426-36 (2000) BindingDB Entry DOI: 10.7270/Q2Q23ZGT
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50084213 ((R)-1-(4-Butoxy-benzenesulfonyl)-4-methoxyamino-py...) Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1CC(C[C@@H]1C(=O)NO)NOC Show InChI InChI=1S/C16H25N3O6S/c1-3-4-9-25-13-5-7-14(8-6-13)26(22,23)19-11-12(18-24-2)10-15(19)16(20)17-21/h5-8,12,15,18,21H,3-4,9-11H2,1-2H3,(H,17,20)/t12?,15-/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	790	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description In vitro inhibition of human recombinant collagenase-1 (Matrix metalloproteinase-1, MMP-1)				J Med Chem 42: 5426-36 (2000) BindingDB Entry DOI: 10.7270/Q2Q23ZGT
					More data for this Ligand-Target Pair