BDBM50028909 2-(7,8-Dichloro-3,4-dihydro-1H-isoquinolin-2-yl)-ethylamine::CHEMBL165132

SMILES: NCCN1CCc2ccc(Cl)c(Cl)c2C1

InChI Key: InChIKey=XDADTCNTHCSDSI-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 = 50028909   

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
Phenylethanolamine N-methyltransferase (Homo sapiens (Human))	BDBM50028909 (2-(7,8-Dichloro-3,4-dihydro-1H-isoquinolin-2-yl)-e...) Show SMILES NCCN1CCc2ccc(Cl)c(Cl)c2C1 Show InChI InChI=1S/C11H14Cl2N2/c12-10-2-1-8-3-5-15(6-4-14)7-9(8)11(10)13/h1-2H,3-7,14H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of rabbit adrenal phenylethanolamine N-methyl-transferase				J Med Chem 24: 756-9 (1981) BindingDB Entry DOI: 10.7270/Q2DZ08VH
					More data for this Ligand-Target Pair				3D Structure (docked)