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CMap Candidate Details

Structure:
CMap ID: C01687
Pert ID: BRD-A94756469
Compound Name: digoxin
Targets: ATP1A1
MoA: ATPase inhibitor
SMILES: C[C@H]1O[C@H](C[C@H](O)[C@@H]1O)O[C@H]1[C@@H](O)C[C@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3CC[C@@]4(C)[C@H](CCC5C4C[C@@H](O)[C@]4(C)[C@H](CC[C@]54O)C4=CC(=O)OC4)C3)O[C@@H]2C)O[C@@H]1C
InchiKey:
Compound Aliases:

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)
5746 BRD-A94756469 HCC515 10 uM 6 h -0.23 -0.96 0.09 -0.46 -1.56 15.65
6504 BRD-A94756469 VCAP 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
41693 BRD-A94756469 A375 10 uM 6 h 0.0 0.0 0.0 -0.45 -1.51 15.35
42245 BRD-A94756469 ASC 10 uM 24 h 0.0 0.0 0.0 -0.27 -0.89 0.27
42583 BRD-A94756469 HEPG2 10 uM 6 h 0.0 0.0 0.0 -0.45 -1.52 15.35
43443 BRD-A94756469 NPC 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
43750 BRD-A94756469 PHH 10 uM 24 h 0.0 0.0 0.0 -0.29 -0.99 0.5
44035 BRD-A94756469 SKB 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128183 BRD-A94756469 HT29 1.11 uM 24 h 0.0 0.0 0.0 -0.39 -1.32 1.71
128210 BRD-A94756469 MCF10A 0.125 uM 24 h 0.19 0.77 0.0 -0.48 -1.62 15.65
128256 BRD-A94756469 MCF??7.00 0.04 uM 24 h 0.24 1.0 0.11 0.0 0.0 0.0
128289 BRD-A94756469 MDAMB231 1.11 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128331 BRD-A94756469 PC3 0.125 uM 24 h 0.0 0.0 0.0 -0.36 -1.21 1.24
128348 BRD-A94756469 THP1 3.33 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
135772 BRD-A94756469 A549 0.74 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
135799 BRD-A94756469 HA1E 0.25 uM 24 h 0.0 0.0 0.0 -0.37 -1.25 1.35
135843 BRD-A94756469 HEK293 0.25 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
135884 BRD-A94756469 HELA 0.25 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
135973 BRD-A94756469 JURKAT 0.25 uM 24 h 0.0 0.0 0.0 -0.32 -1.09 0.82
136119 BRD-A94756469 YAPC 0.25 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
The GSE89632 and GSE126848 datasets are hepatic gene expression profiles of nonalcoholic fatty liver disease (NAFLD).