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

Structure:

CMap ID:	C02893
Pert ID:	BRD-A81177136
Compound Name:	KN-62
Targets:	AKT1\|CAMK2A\|CHEK1\|LCK\|MAPK1\|MAPK11\|MAPK12\|MAPK14\|MAPK8\|P2RX7\|PRKCA\|ROCK1\|RPS6KB1\|SGK1
MoA:	calcium/calmodulin dependent protein kinase inhibitor; purinergic receptor antagonist
SMILES:	CN(C(Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1)C(=O)N1CCN(CC1)c1ccccc1)S(=O)(=O)c1cccc2cnccc12
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)
1513	BRD-A81177136	HA1E	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
1846	BRD-A81177136	HCC515	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
2209	BRD-A81177136	PC3	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
2512	BRD-A81177136	VCAP	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
42237	BRD-A81177136	ASC	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
42578	BRD-A81177136	HEPG2	10 uM	6 h	0.0	0.0	0.0	0.0	0.0	0.0
42883	BRD-A81177136	HT29	10 uM	6 h	0.0	0.0	0.0	0.0	0.0	0.0
43744	BRD-A81177136	PHH	10 uM	24 h	0.3	1.25	0.53	0.0	0.0	0.0
44030	BRD-A81177136	SKB	10 uM	24 h	0.24	1.0	0.11	0.25	0.89	0.2
95765	BRD-A81177136	A375	10 uM	6 h	0.0	0.0	0.0	0.0	0.0	0.0
95788	BRD-A81177136	MCF??7.00	10 uM	6 h	0.0	0.0	0.0	0.34	1.2	1.11
95802	BRD-A81177136	NPC	10 uM	6 h	0.0	0.0	0.0	0.0	0.0	0.0
95900	BRD-A81177136	YAPC	10 uM	6 h	0.0	0.0	0.0	0.33	1.15	0.9
96097	BRD-A81177136	A549	10 uM	24 h	0.0	0.0	0.0	-0.23	-0.77	0.08
100344	BRD-A81177136	U2OS	10 uM	6 h	0.0	0.0	0.0	0.0	0.0	0.0

Summary