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

Structure:

CMap ID:	C03925
Pert ID:	BRD-K00674894
Compound Name:	orteronel
Targets:	CYP17A1
MoA:	androgen biosynthesis inhibitor; androgen receptor antagonist; cytochrome P450 inhibitor
SMILES:	CNC(=O)c1ccc2cc(ccc2c1)[C@]1(O)CCn2cncc12
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)
122855	BRD-K00674894	HA1E	10 uM	24 h	0.17	0.7	0.0	-0.3	-1.01	0.57
122884	BRD-K00674894	HEK293	10 uM	24 h	0.24	1.0	0.1	-0.2	-0.67	0.01
122934	BRD-K00674894	HELA	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
122965	BRD-K00674894	HT29	0.125 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
123009	BRD-K00674894	JURKAT	3.33 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
123098	BRD-K00674894	MDAMB231	10 uM	24 h	0.23	0.97	0.08	0.0	0.0	0.0
123170	BRD-K00674894	THP1	0.04 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
131203	BRD-K00674894	A375	0.03 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
131235	BRD-K00674894	A549	0.25 uM	24 h	0.0	0.0	0.0	0.29	1.02	0.48
131346	BRD-K00674894	HUVEC	0.25 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
131393	BRD-K00674894	MCF10A	2.22 uM	24 h	0.21	0.88	0.02	0.22	0.78	0.06
131428	BRD-K00674894	MCF??7.00	0.25 uM	24 h	0.0	0.0	0.0	-0.29	-0.99	0.5
131456	BRD-K00674894	PC3	0.25 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
131487	BRD-K00674894	YAPC	0.25 uM	24 h	0.27	1.11	0.26	-0.25	-0.84	0.18

Summary