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

Structure:

CMap ID:	C03973
Pert ID:	BRD-K97799481
Compound Name:	oxtriphylline
Targets:	ADORA1\|ADORA2A\|ADORA2B\|ADORA3\|HDAC2\|PDE3A\|PDE4A\|PDE4B\|PDE5A
MoA:	adenosine receptor antagonist
SMILES:	Cn1c2nc[nH]c2c(=O)n(C)c1=O
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)
50440	BRD-K97799481	HCC515	10 uM	6 h	0.0	0.0	0.0	0.0	0.0	0.0
52219	BRD-K97799481	MCF??7.00	10 uM	6 h	0.0	0.0	0.0	0.0	0.0	0.0
52756	BRD-K97799481	HEPG2	4 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
90904	BRD-K97799481	HUH7	20 uM	72 h	0.0	0.0	0.0	0.0	0.0	0.0
127337	BRD-K97799481	A375	0.37 uM	24 h	0.0	0.0	0.0	-0.23	-0.76	0.07
127382	BRD-K97799481	A549	0.04 uM	24 h	0.0	0.0	0.0	0.33	1.16	0.91
127411	BRD-K97799481	HA1E	3.33 uM	24 h	0.0	0.0	0.0	-0.23	-0.76	0.07
127498	BRD-K97799481	JURKAT	0.37 uM	24 h	-0.25	-1.04	0.21	0.0	0.0	0.0
127592	BRD-K97799481	PC3	0.125 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
127635	BRD-K97799481	THP1	1.11 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
127668	BRD-K97799481	YAPC	10 uM	24 h	0.0	0.0	0.0	0.31	1.09	0.68
135359	BRD-K97799481	HELA	2.22 uM	24 h	0.0	0.0	0.0	-0.37	-1.26	1.35
135388	BRD-K97799481	HT29	0.25 uM	24 h	0.0	0.0	0.0	-0.28	-0.93	0.34
135428	BRD-K97799481	MCF10A	0.74 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0

Summary