BDBM50359895 CHEMBL261267

SMILES: [O-][N+](=O)c1cccc(\C=C2/S\C(NC2=O)=N/c2nsc3ccccc23)c1

InChI Key: InChIKey=JWLRMBKRMUREIB-ZROIWOOFSA-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 = 50359895   

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
Collagenase 3 (Homo sapiens (Human))	BDBM50359895 (CHEMBL261267) Show SMILES [O-][N+](=O)c1cccc(\C=C2/S\C(NC2=O)=N/c2nsc3ccccc23)c1 Show InChI InChI=1S/C17H10N4O3S2/c22-16-14(9-10-4-3-5-11(8-10)21(23)24)25-17(19-16)18-15-12-6-1-2-7-13(12)26-20-15/h1-9H,(H,18,19,20,22)/b14-9-	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	5.59E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Catania Curated by ChEMBL					Assay Description Inhibition of MMP13 catalytic domain (unknown origin) assessed as reduction in hydrolysis of Mca-Pro-Leu-Gly-Leu-Dpa-Ala-Arg-NH2 substrate measured f...				Bioorg Med Chem 23: 1551-6 (2015) Article DOI: 10.1016/j.bmc.2015.02.002 BindingDB Entry DOI: 10.7270/Q26T0P92
					More data for this Ligand-Target Pair
Lipoxygenase-1 (Glycine max (soybean))	BDBM50359895 (CHEMBL261267) Show SMILES [O-][N+](=O)c1cccc(\C=C2/S\C(NC2=O)=N/c2nsc3ccccc23)c1 Show InChI InChI=1S/C17H10N4O3S2/c22-16-14(9-10-4-3-5-11(8-10)21(23)24)25-17(19-16)18-15-12-6-1-2-7-13(12)26-20-15/h1-9H,(H,18,19,20,22)/b14-9-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.94E+4	n/a	n/a	n/a	n/a	n/a	n/a
Alexander Technological Education Institute of Thessaloniki Curated by ChEMBL					Assay Description Inhibition of soybean LOX type 1 pre-incubated for 4 mins at 7x10'-7 w/v concentration assessed as inhibition of sodium linoleate to 13-hydroperoxyli...				Eur J Med Chem 47: 111-24 (2012) Article DOI: 10.1016/j.ejmech.2011.10.029 BindingDB Entry DOI: 10.7270/Q2K937ZK
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase) (Ovis aries (Sheep))	BDBM50359895 (CHEMBL261267) Show SMILES [O-][N+](=O)c1cccc(\C=C2/S\C(NC2=O)=N/c2nsc3ccccc23)c1 Show InChI InChI=1S/C17H10N4O3S2/c22-16-14(9-10-4-3-5-11(8-10)21(23)24)25-17(19-16)18-15-12-6-1-2-7-13(12)26-20-15/h1-9H,(H,18,19,20,22)/b14-9-	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+5	n/a	n/a	n/a	n/a	n/a	n/a
Alexander Technological Education Institute of Thessaloniki Curated by ChEMBL					Assay Description Inhibition of ovine COX1 assessed as PGF2alpha production by enzyme immunoassay				Eur J Med Chem 47: 111-24 (2012) Article DOI: 10.1016/j.ejmech.2011.10.029 BindingDB Entry DOI: 10.7270/Q2K937ZK
					More data for this Ligand-Target Pair