BDBM50128614 (R)-2-(4-butoxyphenylsulfonyl)-N-hydroxy-2-methyl-3-(4-(2-(piperidin-1-yl)ethoxy)phenyl)propanamide::2-(4-Butoxy-benzenesulfonyl)-N-hydroxy-2-methyl-3-[4-(2-piperidin-1-yl-ethoxy)-phenyl]-propionamide::CHEMBL306723

SMILES: CCCCOc1ccc(cc1)S(=O)(=O)C(C)(Cc1ccc(OCCN2CCCCC2)cc1)C(=O)NO

InChI Key: InChIKey=IOUQKHPLPLPITI-UHFFFAOYSA-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 = 50128614   

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))	BDBM50128614 ((R)-2-(4-butoxyphenylsulfonyl)-N-hydroxy-2-methyl-...) Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)C(C)(Cc1ccc(OCCN2CCCCC2)cc1)C(=O)NO Show InChI InChI=1S/C27H38N2O6S/c1-3-4-19-34-24-12-14-25(15-13-24)36(32,33)27(2,26(30)28-31)21-22-8-10-23(11-9-22)35-20-18-29-16-6-5-7-17-29/h8-15,31H,3-7,16-21H2,1-2H3,(H,28,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description In vitro inhibition of matrix metalloprotease-9				J Med Chem 46: 2361-75 (2003) Article DOI: 10.1021/jm0205548 BindingDB Entry DOI: 10.7270/Q2RR1ZZJ
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50128614 ((R)-2-(4-butoxyphenylsulfonyl)-N-hydroxy-2-methyl-...) Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)C(C)(Cc1ccc(OCCN2CCCCC2)cc1)C(=O)NO Show InChI InChI=1S/C27H38N2O6S/c1-3-4-19-34-24-12-14-25(15-13-24)36(32,33)27(2,26(30)28-31)21-22-8-10-23(11-9-22)35-20-18-29-16-6-5-7-17-29/h8-15,31H,3-7,16-21H2,1-2H3,(H,28,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description In vitro inhibition of matrix metalloprotease-13				J Med Chem 46: 2361-75 (2003) Article DOI: 10.1021/jm0205548 BindingDB Entry DOI: 10.7270/Q2RR1ZZJ
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50128614 ((R)-2-(4-butoxyphenylsulfonyl)-N-hydroxy-2-methyl-...) Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)C(C)(Cc1ccc(OCCN2CCCCC2)cc1)C(=O)NO Show InChI InChI=1S/C27H38N2O6S/c1-3-4-19-34-24-12-14-25(15-13-24)36(32,33)27(2,26(30)28-31)21-22-8-10-23(11-9-22)35-20-18-29-16-6-5-7-17-29/h8-15,31H,3-7,16-21H2,1-2H3,(H,28,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	761	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description In vitro inhibition of matrix metalloprotease-1				J Med Chem 46: 2361-75 (2003) Article DOI: 10.1021/jm0205548 BindingDB Entry DOI: 10.7270/Q2RR1ZZJ
					More data for this Ligand-Target Pair