CMap Candidate Details

Structure:
CMap ID: C03178
Pert ID: BRD-K02404261
Compound Name: caffeine
Targets: ADORA1; ADORA2A; ADORA2B; ITPR1; ATM; RYR1
MoA: Phosphodiesterase inhibitor; Adenosine receptor antagonist
SMILES: Cn1cnc2n(C)c(=O)n(C)c(=O)c12
InchiKey: RYYVLZVUVIJVGH-UHFFFAOYSA-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)
5568 BRD-K02404261 HCC515 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
6509 BRD-K02404261 VCAP 10 uM 6 h 0.21 0.87 0.01 0.0 0.0 0.0
37576 BRD-K02404261 ASC 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
52892 BRD-K02404261 HEPG2 40 uM 24 h 0.0 0.0 0.0 -0.35 -1.19 1.15
53347 BRD-K02404261 MCF10A 100 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
95534 BRD-K02404261 A549 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
98859 BRD-K02404261 NEU 10 uM 24 h 0.0 0.0 0.0 -0.29 -0.99 0.51
99124 BRD-K02404261 NPC 10 uM 24 h 0.0 0.0 0.0 -0.32 -1.07 0.78
99968 BRD-K02404261 U2OS 10 uM 6 h 0.28 1.18 0.39 0.0 0.0 0.0
122837 BRD-K02404261 A375 10 uM 24 h -0.22 -0.93 0.07 0.0 0.0 0.0
122907 BRD-K02404261 HEK293 0.125 uM 24 h 0.29 1.22 0.47 0.0 0.0 0.0
122945 BRD-K02404261 HELA 10 uM 24 h 0.26 1.09 0.23 0.0 0.0 0.0
122982 BRD-K02404261 HT29 0.37 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
123032 BRD-K02404261 JURKAT 0.04 uM 24 h 0.0 0.0 0.0 -0.38 -1.27 1.43
123122 BRD-K02404261 MDAMB231 0.04 uM 24 h 0.29 1.22 0.48 -0.22 -0.75 0.06
123194 BRD-K02404261 THP1 0.125 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
131287 BRD-K02404261 HA1E 0.25 uM 24 h 0.23 0.95 0.07 -0.33 -1.1 0.86
131370 BRD-K02404261 HUVEC 2.22 uM 24 h 0.0 0.0 0.0 0.35 1.22 1.19
131445 BRD-K02404261 MCF??7.00 2.22 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
131469 BRD-K02404261 PC3 0.25 uM 24 h 0.0 0.0 0.0 -0.33 -1.1 0.86
131507 BRD-K02404261 YAPC 0.01 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).