BDBM50298251 CHEMBL574757::N-(1-(Hydroxyamino)-5-(3-nitroguanidino)-1-oxopentan-2-yl)-2-iodobenzamide

SMILES: NC(NCCC[C@H](NC(=O)c1ccccc1I)C(=O)NO)=N[N+]([O-])=O

InChI Key: InChIKey=FNMVBIGRXKCAGO-JTQLQIEISA-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 = 50298251   

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
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50298251 (CHEMBL574757 | N-(1-(Hydroxyamino)-5-(3-nitroguani...) Show SMILES NC(NCCC[C@H](NC(=O)c1ccccc1I)C(=O)NO)=N[N+]([O-])=O |r,w:21.22| Show InChI InChI=1S/C13H17IN6O5/c14-9-5-2-1-4-8(9)11(21)17-10(12(22)19-23)6-3-7-16-13(15)18-20(24)25/h1-2,4-5,10,23H,3,6-7H2,(H,17,21)(H,19,22)(H3,15,16,18)/t10-/m0/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	1.76E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of MMP2				Bioorg Med Chem 17: 4666-73 (2009) Article DOI: 10.1016/j.bmc.2009.04.056 BindingDB Entry DOI: 10.7270/Q2D21XN3
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM50298251 (CHEMBL574757 | N-(1-(Hydroxyamino)-5-(3-nitroguani...) Show SMILES NC(NCCC[C@H](NC(=O)c1ccccc1I)C(=O)NO)=N[N+]([O-])=O |r,w:21.22| Show InChI InChI=1S/C13H17IN6O5/c14-9-5-2-1-4-8(9)11(21)17-10(12(22)19-23)6-3-7-16-13(15)18-20(24)25/h1-2,4-5,10,23H,3,6-7H2,(H,17,21)(H,19,22)(H3,15,16,18)/t10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of aminopeptidase N in pig kidney microsome by spectrophotometry				Bioorg Med Chem 17: 4666-73 (2009) Article DOI: 10.1016/j.bmc.2009.04.056 BindingDB Entry DOI: 10.7270/Q2D21XN3
					More data for this Ligand-Target Pair