BDBM50416807 CHEMBL1241004

SMILES: CCN(N)CCc1ccc(OC)cc1

InChI Key: InChIKey=KQFNYKZPBWSVPY-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 = 50416807   

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))	BDBM50416807 (CHEMBL1241004) Show SMILES CCN(N)CCc1ccc(OC)cc1 Show InChI InChI=1S/C11H18N2O/c1-3-13(12)9-8-10-4-6-11(14-2)7-5-10/h4-7H,3,8-9,12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	79.4	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