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

Structure:

CMap ID:	C13942
Pert ID:	BRD-K36324071
Compound Name:	NF-449
Targets:	P2RX1
MoA:	Purinergic receptor antagonist
SMILES:	OS(=O)(=O)c1ccc(NC(=O)c2cc(NC(=O)Nc3cc(cc(c3)C(=O)Nc3ccc(c(c3)S(O)(=O)=O)S(O)(=O)=O)C(=O)Nc3ccc(c(c3)S(O)(=O)=O)S(O)(=O)=O)cc(c2)C(=O)Nc2ccc(c(c2)S(O)(=O)=O)S(O)(=O)=O)cc1S(O)(=O)=O
InchiKey:	CPISLWFLHGUZHF-UHFFFAOYSA-N
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)
9415	BRD-K36324071	AGS	10 uM	6 h	0.0	0.0	0.0	-0.26	-0.88	0.24
9723	BRD-K36324071	H1299	10 uM	6 h	0.0	0.0	0.0	0.0	0.0	0.0
10216	BRD-K36324071	HCC515	10 uM	24 h	0.0	0.0	0.0	-0.27	-0.9	0.28
10509	BRD-K36324071	HCT116	10 uM	6 h	0.26	1.1	0.24	0.0	0.0	0.0
10780	BRD-K36324071	HEPG2	10 uM	6 h	0.0	0.0	0.0	0.0	0.0	0.0
11104	BRD-K36324071	HT29	10 uM	6 h	0.0	0.0	0.0	0.0	0.0	0.0
11478	BRD-K36324071	NCIH2073	10 uM	6 h	0.0	0.0	0.0	0.0	0.0	0.0
12042	BRD-K36324071	NCIH596	10 uM	6 h	0.0	0.0	0.0	0.0	0.0	0.0
12540	BRD-K36324071	PC3	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
12784	BRD-K36324071	SW480	10 uM	6 h	0.0	0.0	0.0	-0.27	-0.89	0.27
13265	BRD-K36324071	U937	10 uM	6 h	0.32	1.34	0.89	-0.14	-0.48	0.0
13470	BRD-K36324071	VCAP	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
124281	BRD-K36324071	A375	0.37 uM	24 h	0.0	0.0	0.0	-0.28	-0.94	0.39
124327	BRD-K36324071	HEK293	3.33 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
124365	BRD-K36324071	HELA	10 uM	24 h	0.0	0.0	0.0	-0.32	-1.09	0.82
124557	BRD-K36324071	YAPC	0.125 uM	24 h	0.0	0.0	0.0	-0.21	-0.72	0.04
132368	BRD-K36324071	A549	0.25 uM	24 h	0.25	1.03	0.13	-0.24	-0.8	0.12
132399	BRD-K36324071	HA1E	0.74 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
132505	BRD-K36324071	MCF10A	0.08 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
132534	BRD-K36324071	MCF??7.00	0.74 uM	24 h	0.28	1.15	0.33	-0.29	-0.96	0.44
132561	BRD-K36324071	MDAMB231	0.01 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
132621	BRD-K36324071	THP1	0.08 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0

Summary