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

Structure:

CMap ID:	C03940
Pert ID:	BRD-K85337334
Compound Name:	otilonium
Targets:	CACNA1C
MoA:	acetylcholine receptor antagonist
SMILES:	CCCCCCCCOc1ccccc1C(=O)Nc1ccc(cc1)C(=O)OCC[N+](C)(CC)CC
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)
125990	BRD-K85337334	A549	0.37 uM	24 h	0.0	0.0	0.0	-0.31	-1.05	0.69
126015	BRD-K85337334	HA1E	0.04 uM	24 h	0.0	0.0	0.0	-0.31	-1.03	0.63
126061	BRD-K85337334	HT29	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
126098	BRD-K85337334	HUVEC	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
126147	BRD-K85337334	JURKAT	0.125 uM	24 h	0.0	0.0	0.0	0.23	0.83	0.11
126200	BRD-K85337334	MCF10A	10 uM	24 h	0.0	0.0	0.0	-0.24	-0.81	0.13
126318	BRD-K85337334	THP1	10 uM	24 h	-0.28	-1.17	0.5	-0.29	-0.99	0.5
126348	BRD-K85337334	YAPC	10 uM	24 h	-0.26	-1.08	0.31	0.0	0.0	0.0
134019	BRD-K85337334	A375	0.25 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
134121	BRD-K85337334	HEK293	0.01 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
134163	BRD-K85337334	HELA	2.22 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
134241	BRD-K85337334	MCF??7.00	0.01 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
134274	BRD-K85337334	MDAMB231	0.08 uM	24 h	0.28	1.15	0.32	-0.31	-1.05	0.71
134297	BRD-K85337334	PC3	0.74 uM	24 h	-0.21	-0.86	0.02	0.0	0.0	0.0

Summary