CMap Candidate Details

Structure:
CMap ID: C31365
Pert ID: BRD-K91336023
Compound Name: mesulergine
Targets: HTR2A; HTR2C; HTR7
MoA: Dopamine receptor agonist
SMILES: CN(C)S(=O)(=O)N[C@H]1C[C@H]2[C@@H](Cc3cn(C)c4cccc2c34)N(C)C1
InchiKey: JLVHTNZNKOSCNB-YSVLISHTSA-N
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)
7494 BRD-K91336023 HA1E 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
8851 BRD-K91336023 VCAP 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
91016 BRD-K91336023 HUH7 10 uM 72 h 0.0 0.0 0.0 0.0 0.0 0.0
127340 BRD-K91336023 A375 1.11 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
127383 BRD-K91336023 A549 3.33 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
127501 BRD-K91336023 JURKAT 0.37 uM 24 h 0.0 0.0 0.0 0.28 1.01 0.44
127549 BRD-K91336023 MCF10A 1.11 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
127595 BRD-K91336023 PC3 3.33 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
127637 BRD-K91336023 THP1 3.33 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
127671 BRD-K91336023 YAPC 0.37 uM 24 h 0.17 0.7 0.0 0.25 0.88 0.18
135362 BRD-K91336023 HELA 0.08 uM 24 h 0.0 0.0 0.0 0.34 1.2 1.11
135390 BRD-K91336023 HT29 2.22 uM 24 h 0.22 0.91 0.04 0.24 0.84 0.13
135464 BRD-K91336023 MCF??7.00 0.08 uM 24 h 0.0 0.0 0.0 -0.22 -0.76 0.07
The GSE89632 and GSE126848 datasets are hepatic gene expression profiles of nonalcoholic fatty liver disease (NAFLD).