CKDkb: a knowledge base and platform for drug development against non-alcoholic fatty liver disease

Structure:

CMap ID:	C03652
Pert ID:	BRD-K74117820
Compound Name:	nelfinavir
Targets:	CYP1A2\|CYP2B6\|CYP2C19\|CYP2C9\|CYP2D6\|CYP3A4\|CYP3A7
MoA:	HIV protease inhibitor
SMILES:	Cc1c(O)cccc1C(=O)N[C@@H](CSc1ccccc1)[C@H](O)CN1C[C@H]2CCCC[C@H]2C[C@H]1C(=O)NC(C)(C)C
InchiKey:
Compound Aliases:

The GSE89632 and GSE126848 datasets are hepatic gene expression profiles of nonalcoholic fatty liver disease (NAFLD).
Score ID	Pert ID	Cell Line	Pert Dose	Pert Time	Raw Score (GSE126848)	Normalized Score (GSE126848)	fdr_q_nlog10 (GSE126848)	Raw Score (GSE135251)	Normalized Score (GSE135251)	fdr_q_nlog10 (GSE135251)
1245	BRD-K74117820	A549	10 uM	48 h	-0.21	-0.86	0.01	-0.36	-1.21	1.22
1287	BRD-K74117820	MCF??7.00	10 uM	48 h	0.0	0.0	0.0	0.0	0.0	0.0
1387	BRD-K74117820	U2OS	10 uM	6 h	0.0	0.0	0.0	-0.31	-1.06	0.73
24806	BRD-K74117820	HA1E	10 uM	6 h	0.0	0.0	0.0	0.27	0.97	0.35
24943	BRD-K74117820	HT29	10 uM	6 h	0.17	0.72	0.0	0.36	1.26	1.29
25186	BRD-K74117820	PC3	10 uM	24 h	0.2	0.83	0.0	-0.31	-1.05	0.7
25417	BRD-K74117820	VCAP	10 uM	24 h	-0.15	-0.62	0.0	0.0	0.0	0.0
91417	BRD-K74117820	HUH7	4 uM	72 h	0.0	0.0	0.0	0.0	0.0	0.0
97179	BRD-K74117820	A375	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0

Summary