BDBM50063133 (R)-3-Methyl-2-[4-(2-phenyl-2H-tetrazol-5-yl)-benzenesulfonylamino]-butyric acid::CHEMBL288750

SMILES: CC(C)[C@@H](NS(=O)(=O)c1ccc(cc1)-c1nnn(n1)-c1ccccc1)C(O)=O

InChI Key: InChIKey=VTEHMCYSJRSGPC-MRXNPFEDSA-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 = 50063133   

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))	BDBM50063133 ((R)-3-Methyl-2-[4-(2-phenyl-2H-tetrazol-5-yl)-benz...) Show SMILES CC(C)[C@@H](NS(=O)(=O)c1ccc(cc1)-c1nnn(n1)-c1ccccc1)C(O)=O Show InChI InChI=1S/C18H19N5O4S/c1-12(2)16(18(24)25)21-28(26,27)15-10-8-13(9-11-15)17-19-22-23(20-17)14-6-4-3-5-7-14/h3-12,16,21H,1-2H3,(H,24,25)/t16-/m1/s1	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	110	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi & Co., Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against human gelatinase B (Matrix metalloproteinase-9)				J Med Chem 41: 640-9 (1998) Article DOI: 10.1021/jm9707582 BindingDB Entry DOI: 10.7270/Q2HD7TS9
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50063133 ((R)-3-Methyl-2-[4-(2-phenyl-2H-tetrazol-5-yl)-benz...) Show SMILES CC(C)[C@@H](NS(=O)(=O)c1ccc(cc1)-c1nnn(n1)-c1ccccc1)C(O)=O Show InChI InChI=1S/C18H19N5O4S/c1-12(2)16(18(24)25)21-28(26,27)15-10-8-13(9-11-15)17-19-22-23(20-17)14-6-4-3-5-7-14/h3-12,16,21H,1-2H3,(H,24,25)/t16-/m1/s1	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	130	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi & Co., Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against human gelatinase A (matrix metalloproteinase-2 MMP2)				J Med Chem 41: 640-9 (1998) Article DOI: 10.1021/jm9707582 BindingDB Entry DOI: 10.7270/Q2HD7TS9
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50063133 ((R)-3-Methyl-2-[4-(2-phenyl-2H-tetrazol-5-yl)-benz...) Show SMILES CC(C)[C@@H](NS(=O)(=O)c1ccc(cc1)-c1nnn(n1)-c1ccccc1)C(O)=O Show InChI InChI=1S/C18H19N5O4S/c1-12(2)16(18(24)25)21-28(26,27)15-10-8-13(9-11-15)17-19-22-23(20-17)14-6-4-3-5-7-14/h3-12,16,21H,1-2H3,(H,24,25)/t16-/m1/s1	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	72	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi & Company, Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against Matrix metalloproteinase-9 (concentration required for 50% inhibition of enzyme activity)				J Med Chem 42: 1723-38 (1999) Article DOI: 10.1021/jm980514x BindingDB Entry DOI: 10.7270/Q2KP81BQ
					More data for this Ligand-Target Pair