CMap Candidate Details

Structure:
CMap ID: C07861
Pert ID: BRD-K17306061
Compound Name: aprepitant
Targets: TACR1
MoA: Tachykinin antagonist
SMILES: C[C@@H](O[C@@H]1OCCN(Cc2nc(=O)[nH][nH]2)[C@@H]1c1ccc(F)cc1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
InchiKey: NLYKDVVWGQZEED-BYYRLHKVSA-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)
33616 BRD-K17306061 A375 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
34055 BRD-K17306061 ASC 10 uM 24 h 0.0 0.0 0.0 0.27 0.94 0.29
34570 BRD-K17306061 HCC515 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
34840 BRD-K17306061 HEPG2 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
35105 BRD-K17306061 HT29 10 uM 6 h 0.0 0.0 0.0 -0.27 -0.92 0.34
35301 BRD-K17306061 MCF??7.00 10 uM 24 h 0.0 0.0 0.0 0.27 0.95 0.32
35547 BRD-K17306061 NEU 10 uM 24 h 0.23 0.95 0.07 0.0 0.0 0.0
35740 BRD-K17306061 NPC 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
36063 BRD-K17306061 PC3 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
36214 BRD-K17306061 PHH 10 uM 24 h -0.19 -0.79 0.0 0.31 1.11 0.72
36509 BRD-K17306061 SKB 10 uM 24 h 0.21 0.88 0.01 0.0 0.0 0.0
36952 BRD-K17306061 VCAP 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
96119 BRD-K17306061 A549 10 uM 24 h 0.0 0.0 0.0 -0.28 -0.95 0.41
The GSE89632 and GSE126848 datasets are hepatic gene expression profiles of nonalcoholic fatty liver disease (NAFLD).