BDBM50523896 CHEMBL4585478

SMILES: COc1ccc(cc1)S(=O)(=O)C1CCC[C@@H]1C(=O)NO

InChI Key: InChIKey=ANANJHAIYQIZQE-PXYINDEMSA-N

Data: 2 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 2 hits for monomerid = 50523896   

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
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50523896 (CHEMBL4585478) Show SMILES COc1ccc(cc1)S(=O)(=O)C1CCC[C@@H]1C(=O)NO |r| Show InChI InChI=1S/C13H17NO5S/c1-19-9-5-7-10(8-6-9)20(17,18)12-4-2-3-11(12)13(15)14-16/h5-8,11-12,16H,2-4H2,1H3,(H,14,15)/t11-,12?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.90	n/a	n/a	n/a	n/a	n/a	n/a
University of Florence Curated by ChEMBL					Assay Description Inhibition of MMP2 (unknown origin) pre-incubated for 5 mins before Mca-Lys-Pro-Leu-Gly-Leu-Dpa-Ala-Arg-NH2 fluorogenic substrate addition and measur...				Bioorg Med Chem 27: 1891-1902 (2019) Article DOI: 10.1016/j.bmc.2019.03.043
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50523896 (CHEMBL4585478) Show SMILES COc1ccc(cc1)S(=O)(=O)C1CCC[C@@H]1C(=O)NO |r| Show InChI InChI=1S/C13H17NO5S/c1-19-9-5-7-10(8-6-9)20(17,18)12-4-2-3-11(12)13(15)14-16/h5-8,11-12,16H,2-4H2,1H3,(H,14,15)/t11-,12?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
University of Florence Curated by ChEMBL					Assay Description Inhibition of MMP9 (unknown origin) pre-incubated for 5 mins before Mca-Lys-Pro-Leu-Gly-Leu-Dpa-Ala-Arg-NH2 fluorogenic substrate addition and measur...				Bioorg Med Chem 27: 1891-1902 (2019) Article DOI: 10.1016/j.bmc.2019.03.043
					More data for this Ligand-Target Pair