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

Structure:

CMap ID:	C00233
Pert ID:	BRD-K53979406
Compound Name:	ALX-5407
Targets:	SLC6A9
MoA:	Glycine transporter 1 inhibitor
SMILES:	CN(CC[C@@H](Oc1ccc(cc1)-c1ccccc1)c1ccc(F)cc1)CC(O)=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)
8831	BRD-K53979406	VCAP	10 uM	6 h	0.0	0.0	0.0	-0.39	-1.32	1.71
124303	BRD-K53979406	HA1E	0.125 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
124356	BRD-K53979406	HELA	0.125 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
124423	BRD-K53979406	JURKAT	3.33 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
124469	BRD-K53979406	MCF??7.00	10 uM	24 h	0.22	0.91	0.03	0.26	0.91	0.23
124521	BRD-K53979406	PC3	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
132334	BRD-K53979406	A375	0.01 uM	24 h	0.0	0.0	0.0	0.31	1.1	0.69
132361	BRD-K53979406	A549	0.08 uM	24 h	-0.17	-0.71	0.0	0.27	0.95	0.31
132427	BRD-K53979406	HEK293	0.03 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
132467	BRD-K53979406	HT29	0.03 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
132497	BRD-K53979406	MCF10A	0.03 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
132555	BRD-K53979406	MDAMB231	0.01 uM	24 h	0.24	1.02	0.12	0.29	1.02	0.49
132611	BRD-K53979406	THP1	2.22 uM	24 h	0.29	1.2	0.42	-0.16	-0.53	0.0
132643	BRD-K53979406	YAPC	2.22 uM	24 h	-0.17	-0.71	0.0	0.32	1.13	0.85

Summary