BDBM50441217 CHEMBL2431024

SMILES: COc1ccc(cc1)-c1cc(Br)cc(COc2ccc(cc2)S(=O)(=O)NCC(=O)NO)c1

InChI Key: InChIKey=HPKAGMQWGBOAOT-UHFFFAOYSA-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 = 50441217   

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
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50441217 (CHEMBL2431024) Show SMILES COc1ccc(cc1)-c1cc(Br)cc(COc2ccc(cc2)S(=O)(=O)NCC(=O)NO)c1 Show InChI InChI=1S/C22H21BrN2O6S/c1-30-19-4-2-16(3-5-19)17-10-15(11-18(23)12-17)14-31-20-6-8-21(9-7-20)32(28,29)24-13-22(26)25-27/h2-12,24,27H,13-14H2,1H3,(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Inhibition of recombinant human ADAM-17 using Mca-Lys-Pro-Leu-Gly-Leu-Dap(Dnp)-Ala-Arg-NH2 as substrate incubated for 30 mins measured every 15 secs ...				J Med Chem 56: 8089-103 (2013) Article DOI: 10.1021/jm4011753 BindingDB Entry DOI: 10.7270/Q2DR2WZ0
					More data for this Ligand-Target Pair
Matrix metalloproteinase-14 (Homo sapiens (Human))	BDBM50441217 (CHEMBL2431024) Show SMILES COc1ccc(cc1)-c1cc(Br)cc(COc2ccc(cc2)S(=O)(=O)NCC(=O)NO)c1 Show InChI InChI=1S/C22H21BrN2O6S/c1-30-19-4-2-16(3-5-19)17-10-15(11-18(23)12-17)14-31-20-6-8-21(9-7-20)32(28,29)24-13-22(26)25-27/h2-12,24,27H,13-14H2,1H3,(H,25,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+5	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Inhibition of recombinant human MMP-14 catalytic domain using Mca-Lys-Pro-Leu-Gly-Leu-Dap(Dnp)-Ala-Arg-NH2 as substrate incubated for 4 hrs measured ...				J Med Chem 56: 8089-103 (2013) Article DOI: 10.1021/jm4011753 BindingDB Entry DOI: 10.7270/Q2DR2WZ0
					More data for this Ligand-Target Pair