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iGMDRD659

Canonical SMILES: C1=CC(=CC=C1S(=O)(=O)N(CC2=C(C=C(C=C2)C3=NOC=N3)F)C(CCC(F)(F)F)C(=O)N)Cl

InChI: InChI=1S/C20H17ClF4N4O4S/c21-14-3-5-15(6-4-14)34(31,32)29(17(18(26)30)7-8-20(23,24)25)10-13-2-1-12(9-16(13)22)19-27-11-33-28-19/h1-6,9,11,17H,7-8,10H2,(H2,26,30)/t17-/m1/s1

InChI Key: XEAOPVUAMONVLA-QGZVFWFLSA-N

Standard Name	CHEMBL	Pubchem CID	DRUGBANK ID	Drug Status	Drug Type
Avagacestat (BMS-708163)	CHEMBL1090771	46883500	DB11893	Alone	Small Molecule

Drug Class:

Amides Amyloid Precursor Protein Secretases, antagonists & inhibitors Azoles Heterocyclic Compounds Heterocyclic Compounds, 1-Ring Oxazoles Sulfones Sulfur Compounds

Drug Targets:

g-secretase Amyloid beta20 Amyloid beta40

Drug-model tissue-cancer distribution: Bubble Plot

Drug-gene pathway enrichments

Drug-gene GO enrichments

Drug-Gene: Aster Plot

Gene ID	Gene Name	Model Num.
3845	KRAS	1
9757	KMT2B	1
9611	NCOR1	2
1111	CHEK1	1
1108	CHD4	1
5518	PPP2R1A	1
2064	ERBB2	1
2778	GNAS	1
3932	LCK	1
7157	TP53	2
3673	ITGA2	1
6714	SRC	1
6794	STK11	1
7422	VEGFA	1
1654	DDX3X	1
80205	CHD9	1
4089	SMAD4	1
3105	HLA-A	1
7270	TTF1	1
1956	EGFR	1
4609	MYC	1
3553	IL1B	3
673	BRAF	1
100862685	ERVK-19	1

Gene in drug-gene network: Network Plot

Models in Avagacestat (BMS-708163)

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DATATYPES

CLASSFICATION

Disclaimer: iGMDR is intended for research purposes only. Its information cannot be used for emergencies or medical or professional advice.