BDBM50062478 CHEMBL116641::N-Hydroxy-2-isobutyl-N'-(3-phenyl-propyl)-malonamide::N1-hydroxy-2-isobutyl-N3-(3-phenylpropyl)malonamide

SMILES: CC(C)CC(C(=O)NO)C(=O)NCCCc1ccccc1

InChI Key: InChIKey=XKYMHQLYNCGEBF-UHFFFAOYSA-N

Data: 2 KI  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 4 hits for monomerid = 50062478   

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
Neutrophil collagenase (Homo sapiens (Human))	BDBM50062478 (CHEMBL116641 | N-Hydroxy-2-isobutyl-N'-(3-phenyl-p...) Show SMILES CC(C)CC(C(=O)NO)C(=O)NCCCc1ccccc1 Show InChI InChI=1S/C16H24N2O3/c1-12(2)11-14(16(20)18-21)15(19)17-10-6-9-13-7-4-3-5-8-13/h3-5,7-8,12,14,21H,6,9-11H2,1-2H3,(H,17,19)(H,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	537	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pomona College Curated by ChEMBL					Assay Description Inhibition of MMP8				Bioorg Med Chem 15: 2223-68 (2007) Article DOI: 10.1016/j.bmc.2007.01.011 BindingDB Entry DOI: 10.7270/Q2571DBD
					More data for this Ligand-Target Pair
Neutrophil collagenase (Homo sapiens (Human))	BDBM50062478 (CHEMBL116641 | N-Hydroxy-2-isobutyl-N'-(3-phenyl-p...) Show SMILES CC(C)CC(C(=O)NO)C(=O)NCCCc1ccccc1 Show InChI InChI=1S/C16H24N2O3/c1-12(2)11-14(16(20)18-21)15(19)17-10-6-9-13-7-4-3-5-8-13/h3-5,7-8,12,14,21H,6,9-11H2,1-2H3,(H,17,19)(H,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	540	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut für Biochemie Curated by ChEMBL					Assay Description Inhibition of Matrix metalloproteinase-8 (Human neutrophil collagenase, MMP-8)				J Med Chem 41: 339-45 (1998) Article DOI: 10.1021/jm9706426 BindingDB Entry DOI: 10.7270/Q2639NWF
					More data for this Ligand-Target Pair
Zinc aminopeptidase (Plasmodium falciparum (isolate FcB1 / Columbia))	BDBM50062478 (CHEMBL116641 | N-Hydroxy-2-isobutyl-N'-(3-phenyl-p...) Show SMILES CC(C)CC(C(=O)NO)C(=O)NCCCc1ccccc1 Show InChI InChI=1S/C16H24N2O3/c1-12(2)11-14(16(20)18-21)15(19)17-10-6-9-13-7-4-3-5-8-13/h3-5,7-8,12,14,21H,6,9-11H2,1-2H3,(H,17,19)(H,18,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	790	n/a	n/a	n/a	n/a	n/a	n/a
Inserm Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum FcB1 M1 aminopeptidase				J Med Chem 50: 1322-34 (2007) Article DOI: 10.1021/jm061169b BindingDB Entry DOI: 10.7270/Q2M908B3
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM50062478 (CHEMBL116641 | N-Hydroxy-2-isobutyl-N'-(3-phenyl-p...) Show SMILES CC(C)CC(C(=O)NO)C(=O)NCCCc1ccccc1 Show InChI InChI=1S/C16H24N2O3/c1-12(2)11-14(16(20)18-21)15(19)17-10-6-9-13-7-4-3-5-8-13/h3-5,7-8,12,14,21H,6,9-11H2,1-2H3,(H,17,19)(H,18,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	528	n/a	n/a	n/a	n/a	n/a	n/a
University of Lille 2 Curated by ChEMBL					Assay Description Inhibition of microsomal neural aminopeptidase in pig kidney				Bioorg Med Chem 15: 63-76 (2006) Article DOI: 10.1016/j.bmc.2006.10.010 BindingDB Entry DOI: 10.7270/Q23F4P9V
					More data for this Ligand-Target Pair