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

Structure:

CMap ID:	C01594
Pert ID:	BRD-K45503887
Compound Name:	delivert
Targets:	AGTR1\|AGTR2
MoA:	angiotensin receptor agonist
SMILES:	CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@@H]1C(=O)N[C@H](Cc1ccccc1)C(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)
125234	BRD-K45503887	A375	10 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
125299	BRD-K45503887	HEK293	3.33 uM	24 h	0.27	1.14	0.32	0.17	0.6	0.0
125434	BRD-K45503887	MCF??7.00	1.11 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
125471	BRD-K45503887	MDAMB231	3.33 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
125488	BRD-K45503887	PC3	0.04 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
133358	BRD-K45503887	A549	0.01 uM	24 h	0.21	0.89	0.02	0.29	1.03	0.51
133382	BRD-K45503887	HA1E	0.74 uM	24 h	0.0	0.0	0.0	-0.39	-1.33	1.71
133410	BRD-K45503887	HELA	2.22 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
133445	BRD-K45503887	HT29	0.01 uM	24 h	-0.23	-0.96	0.1	-0.16	-0.53	0.0
133475	BRD-K45503887	JURKAT	0.03 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
133506	BRD-K45503887	MCF10A	0.74 uM	24 h	0.21	0.89	0.02	0.0	0.0	0.0
133599	BRD-K45503887	THP1	0.01 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0
133621	BRD-K45503887	YAPC	0.74 uM	24 h	0.0	0.0	0.0	0.0	0.0	0.0

Summary