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

Structure:

CMap ID:	C03771
Pert ID:	BRD-K85307935
Compound Name:	novobiocin
Targets:
MoA:	bacterial DNA gyrase inhibitor
SMILES:	CO[C@@H]1[C@@H](OC(N)=O)[C@@H](O)[C@H](Oc2ccc3c(O)c(NC(=O)c4ccc(O)c(CC=C(C)C)c4)c(=O)oc3c2C)OC1(C)C
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)
52204	BRD-K85307935	MCF??7.00	10 uM	6 h	0.34	1.44	1.12	0.0	0.0	0.0
126016	BRD-K85307935	HA1E	10 uM	24 h	0.0	0.0	0.0	-0.22	-0.75	0.06
126062	BRD-K85307935	HT29	3.33 uM	24 h	0.28	1.15	0.34	0.31	1.09	0.67
126150	BRD-K85307935	JURKAT	1.11 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
126201	BRD-K85307935	MCF10A	1.11 uM	24 h	-0.33	-1.37	1.08	0.33	1.17	0.92
126245	BRD-K85307935	MDAMB231	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
126272	BRD-K85307935	PC3	1.11 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
126320	BRD-K85307935	THP1	3.33 uM	24 h	0.0	0.0	0.0	-0.22	-0.75	0.07
134021	BRD-K85307935	A375	0.74 uM	24 h	0.25	1.02	0.13	0.0	0.0	0.0
134050	BRD-K85307935	A549	2.22 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
134124	BRD-K85307935	HEK293	0.25 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
134165	BRD-K85307935	HELA	2.22 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
134213	BRD-K85307935	HUVEC	0.25 uM	24 h	0.0	0.0	0.0	0.39	1.37	2.11
134328	BRD-K85307935	YAPC	0.74 uM	24 h	0.0	0.0	0.0	0.27	0.95	0.31

Summary