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CMap Candidate Details

Structure:
CMap ID: C03668
Pert ID: BRD-K97428065
Compound Name: netupitant
Targets: TACR1
MoA: tachykinin antagonist
SMILES: CN(C(=O)C(C)(C)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cnc(cc1-c1ccccc1C)N1CCN(C)CC1
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)
96305 BRD-K97428065 A375 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128401 BRD-K97428065 A549 0.37 uM 24 h 0.22 0.9 0.03 0.29 1.02 0.49
128410 BRD-K97428065 HA1E 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128461 BRD-K97428065 HEK293 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128486 BRD-K97428065 HELA 10 uM 24 h 0.2 0.85 0.01 0.0 0.0 0.0
128517 BRD-K97428065 HT29 10 uM 24 h -0.21 -0.86 0.02 0.0 0.0 0.0
128571 BRD-K97428065 JURKAT 0.125 uM 24 h 0.0 0.0 0.0 0.28 0.99 0.39
128605 BRD-K97428065 MCF10A 10 uM 24 h -0.16 -0.65 0.0 0.0 0.0 0.0
128614 BRD-K97428065 MCF??7.00 10 uM 24 h 0.2 0.85 0.0 -0.32 -1.09 0.82
128663 BRD-K97428065 MDAMB231 1.11 uM 24 h 0.0 0.0 0.0 -0.38 -1.28 1.45
128694 BRD-K97428065 PC3 10 uM 24 h 0.0 0.0 0.0 0.24 0.83 0.12
128742 BRD-K97428065 THP1 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128781 BRD-K97428065 YAPC 10 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).