BDBM50225227 2,4-dichloro-1-(4-(chloromethyl)-2-methoxyphenoxy)benzene::CHEMBL240807

SMILES: COc1cc(CCl)ccc1Oc1ccc(Cl)cc1Cl

InChI Key: InChIKey=KGFZDWAEBKKPMK-UHFFFAOYSA-N

Data: 1 IC50

PDB links: 1 PDB ID matches this monomer.

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 = 50225227   

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
Transthyretin (Homo sapiens (Human))	BDBM50225227 (2,4-dichloro-1-(4-(chloromethyl)-2-methoxyphenoxy)...) Show SMILES COc1cc(CCl)ccc1Oc1ccc(Cl)cc1Cl Show InChI InChI=1S/C14H11Cl3O2/c1-18-14-6-9(8-15)2-4-13(14)19-12-5-3-10(16)7-11(12)17/h2-7H,8H2,1H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	3.16E+3	n/a	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Inhibition of transthyretin fibril formation at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
					More data for this Ligand-Target Pair				3D Structure (crystal)