ESTHER Database

Biological
data

ESTHER definition

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Inhibitor

Inhibitor Report for: ARUK3004903

General

Type		Fragment inhibitor of Notum, Indole
Chemical_Nomenclature		1-[3,4-bis(chloranyl)-5-methyl-indol-1-yl]ethanone
Canonical SMILES		[C]1=C(C(=C2C(=[C]1)[N]([C]=C2Cl)C([C])=O)Cl)[C]
InChI		InChI=1S/C11H9Cl2NO/c1-6-3-4-9-10(11(6)13)8(12)5-14(9)7(2)15/h3-5H,1-2H3
InChIKey		IETDZXPYBWJKDH-UHFFFAOYSA-N
Other name(s)		RL6

________________________________________________________________________________________________

MW	\|	242.10
Formula	\|	C11H9Cl2NO
CAS_number	\|
PubChem	\|
UniChem	\|	IETDZXPYBWJKDH-UHFFFAOYSA-N
IUPHAR	\|
Wikipedia	\|

Target

Families	\|	ARUK3004903 ligand of proteins in family: Pectinacetylesterase-Notum
Stucture	\|	1 structure: 8BT7: Structure of the Wnt deacylase Notum in complex with ARUK3004903
Protein	\|	human-NOTUM

References:

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