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CMap Candidate Details

Structure:
CMap ID: C05106
Pert ID: BRD-K12539416
Compound Name: sulbutiamine
Targets:
MoA: acetylcholine receptor antagonist
SMILES: CC(C)C(=O)OCC\C(SS\C(CCOC(=O)C(C)C)=C(/C)N(Cc1cnc(C)nc1N)C=O)=C(\C)N(Cc1cnc(C)nc1N)C=O
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)
122238 BRD-K12539416 A375 10 uM 24 h -0.18 -0.77 0.0 0.32 1.14 0.85
122281 BRD-K12539416 A549 10 uM 24 h 0.0 0.0 0.0 0.2 0.7 0.02
122382 BRD-K12539416 MCF??7.00 10 uM 24 h 0.19 0.79 0.0 0.0 0.0 0.0
122407 BRD-K12539416 MDAMB231 3.33 uM 24 h 0.0 0.0 0.0 0.22 0.8 0.08
122461 BRD-K12539416 THP1 10 uM 24 h -0.22 -0.91 0.05 -0.28 -0.96 0.43
122509 BRD-K12539416 YAPC 0.04 uM 24 h 0.0 0.0 0.0 -0.37 -1.25 1.35
130582 BRD-K12539416 HA1E 0.03 uM 24 h 0.0 0.0 0.0 -0.24 -0.8 0.11
130614 BRD-K12539416 HEK293 0.25 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
130654 BRD-K12539416 HELA 2.22 uM 24 h -0.18 -0.75 0.0 0.0 0.0 0.0
130695 BRD-K12539416 HT29 0.74 uM 24 h -0.23 -0.97 0.11 0.0 0.0 0.0
130734 BRD-K12539416 MCF10A 2.22 uM 24 h 0.23 0.98 0.09 0.0 0.0 0.0
130807 BRD-K12539416 PC3 0.01 uM 24 h 0.0 0.0 0.0 -0.25 -0.83 0.17
The GSE89632 and GSE126848 datasets are hepatic gene expression profiles of nonalcoholic fatty liver disease (NAFLD).