BDBM50416805 CHEMBL1241068

SMILES: COc1ccc(CCN(N)CC(C)C)cc1

InChI Key: InChIKey=OSCSOCYOPLCFBM-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50416805   

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
Vascular adhesion protein 1 (VAP-1) (Homo sapiens (Human))	BDBM50416805 (CHEMBL1241068) Show SMILES COc1ccc(CCN(N)CC(C)C)cc1 Show InChI InChI=1S/C13H22N2O/c1-11(2)10-15(14)9-8-12-4-6-13(16-3)7-5-12/h4-7,11H,8-10,14H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	257	n/a	n/a	n/a	n/a	n/a	n/a
FI-40014 University of Jyvaskyla Curated by ChEMBL					Assay Description Inhibition of human recombinant VAP-1 expressed in CHO cells after 30 mins by coupled colorimetric method				J Med Chem 53: 6301-15 (2010) Article DOI: 10.1021/jm100337z BindingDB Entry DOI: 10.7270/Q2V1261D
					More data for this Ligand-Target Pair