BDBM85460 Pyrazolooxadiazinone, 2a

SMILES: Cc1nn(c2NC(=O)ONc12)-c1ccccc1

InChI Key: InChIKey=AYLWMOAWKCNOFN-UHFFFAOYSA-N

Data: 1 KI

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 1 hit for monomerid = 85460   

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
Leukocyte elastase (Homo sapiens (Human))	BDBM85460 (Pyrazolooxadiazinone, 2a) Show SMILES Cc1nn(c2NC(=O)ONc12)-c1ccccc1 Show InChI InChI=1S/C11H10N4O2/c1-7-9-10(12-11(16)17-14-9)15(13-7)8-5-3-2-4-6-8/h2-6,14H,1H3,(H,12,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	9.40E+4	-5.49	n/a	n/a	n/a	n/a	n/a	n/a	25
Università di Ferrara					Assay Description The enzyme were assayed spectrophotometrically at 410nm with p-nitroanilide substrates at 25 C.				J Enzym Inhib 16: 15-34 (2001) Article DOI: 10.1080/14756360109162352 BindingDB Entry DOI: 10.7270/Q2XP73FM
					More data for this Ligand-Target Pair