BindingDB PrimarySearch

BDBM50286327 4,6-Dimethoxy-1,1-dioxo-2-(1-phenyl-1H-tetrazol-5-ylsulfanylmethyl)-1,2-dihydro-1lambda*6*-benzo[d]isothiazol-3-one::CHEMBL319723

SMILES: COc1cc2c(C(=O)N(CSc3nnnn3-c3ccccc3)S2(=O)=O)c(OC)c1

InChI Key: InChIKey=OHKSYBZANUOMSB-UHFFFAOYSA-N

Data: 5 KI 2 K_off 3 K_on

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50286327
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Leukocyte elastase (Homo sapiens (Human))	BDBM50286327 (4,6-Dimethoxy-1,1-dioxo-2-(1-phenyl-1H-tetrazol-5-...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	0.600	n/a	n/a	n/a	n/a	n/a	4.90E+4	n/a	n/a
TBA Curated by ChEMBL					Assay Description Apparent binding constant Ki=Kon/Koff				Bioorg Med Chem Lett 6: 2941-2946 (1996) Article DOI: 10.1016/S0960-894X(96)00553-7 BindingDB Entry DOI: 10.7270/Q2KP825W
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Leukocyte elastase (Homo sapiens (Human))	BDBM50286327 (4,6-Dimethoxy-1,1-dioxo-2-(1-phenyl-1H-tetrazol-5-...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	0.600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Ratio of Koff to that of Kon was determined on human leukocyte elastase(HLE)				Bioorg Med Chem Lett 5: 331-336 (1995) Article DOI: 10.1016/0960-894X(95)00030-W BindingDB Entry DOI: 10.7270/Q2SX6D60
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Leukocyte elastase (Homo sapiens (Human))	BDBM50286327 (4,6-Dimethoxy-1,1-dioxo-2-(1-phenyl-1H-tetrazol-5-...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	0.600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Apparent binding constant Ki=Kon/Koff				Bioorg Med Chem Lett 6: 2941-2946 (1996) Article DOI: 10.1016/S0960-894X(96)00553-7 BindingDB Entry DOI: 10.7270/Q2KP825W
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Pancreatic elastase (Sus scrofa)	BDBM50286327 (4,6-Dimethoxy-1,1-dioxo-2-(1-phenyl-1H-tetrazol-5-...) Show SMILES Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	15	n/a	n/a	n/a	n/a	n/a	1.30E+3	n/a	n/a
TBA Curated by ChEMBL					Assay Description Apparent binding constant Ki=Kon/Koff				Bioorg Med Chem Lett 6: 2941-2946 (1996) Article DOI: 10.1016/S0960-894X(96)00553-7 BindingDB Entry DOI: 10.7270/Q2KP825W
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Pancreatic elastase (Sus scrofa)	BDBM50286327 (4,6-Dimethoxy-1,1-dioxo-2-(1-phenyl-1H-tetrazol-5-...) Show SMILES Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Apparent binding constant Ki=Kon/Koff				Bioorg Med Chem Lett 6: 2941-2946 (1996) Article DOI: 10.1016/S0960-894X(96)00553-7 BindingDB Entry DOI: 10.7270/Q2KP825W
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Leukocyte elastase (Homo sapiens (Human))	BDBM50286327 (4,6-Dimethoxy-1,1-dioxo-2-(1-phenyl-1H-tetrazol-5-...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	n/a	n/a	n/a	0.0000290	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Evaluated for inhibitory activity against Human leukocyte elastase (HLE)				Bioorg Med Chem Lett 5: 331-336 (1995) Article DOI: 10.1016/0960-894X(95)00030-W BindingDB Entry DOI: 10.7270/Q2SX6D60
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Leukocyte elastase (Homo sapiens (Human))	BDBM50286327 (4,6-Dimethoxy-1,1-dioxo-2-(1-phenyl-1H-tetrazol-5-...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	n/a	n/a	n/a	0.0000290	4.90E+4	n/a	n/a
TBA Curated by ChEMBL					Assay Description Evaluated for inhibitory activity against Human leukocyte elastase (HLE)				Bioorg Med Chem Lett 5: 331-336 (1995) Article DOI: 10.1016/0960-894X(95)00030-W BindingDB Entry DOI: 10.7270/Q2SX6D60
TBA Curated by ChEMBL					More data for this Ligand-Target Pair