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CMap Candidate Details

Structure:
CMap ID: C05475
Pert ID: BRD-K10852020
Compound Name: tolcapone
Targets: COMT
MoA: catechol O methyltransferase inhibitor
SMILES: Cc1ccc(cc1)C(=O)c1cc(O)c(O)c(c1)[N+]([O-])=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)
51128 BRD-K10852020 VCAP 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
91094 BRD-K10852020 HUH7 12 uM 72 h -0.23 -0.96 0.1 0.0 0.0 0.0
98338 BRD-K10852020 NEU 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
98672 BRD-K10852020 NPC 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
121195 BRD-K10852020 A549 10 uM 24 h 0.0 0.0 0.0 0.18 0.64 0.0
121228 BRD-K10852020 HA1E 0.04 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
121254 BRD-K10852020 HELA 0.04 uM 24 h 0.0 0.0 0.0 0.3 1.08 0.65
121291 BRD-K10852020 MCF??7.00 0.04 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
129249 BRD-K10852020 A375 2.22 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
129308 BRD-K10852020 HT29 0.01 uM 24 h 0.0 0.0 0.0 -0.43 -1.46 15.35
129355 BRD-K10852020 PC3 0.03 uM 24 h 0.24 1.01 0.11 0.0 0.0 0.0
129380 BRD-K10852020 YAPC 2.22 uM 24 h 0.0 0.0 0.0 -0.32 -1.07 0.75
The GSE89632 and GSE126848 datasets are hepatic gene expression profiles of nonalcoholic fatty liver disease (NAFLD).