CMap Candidate Details

Structure:
CMap ID: C33403
Pert ID: BRD-K97799481
Compound Name: theophylline
Targets: ADORA1; ADORA2A; ADORA2B; ADORA3; PDE3A; PDE4A; PDE4B
MoA: Adenosine receptor antagonist
SMILES: Cn1c2nc[nH]c2c(=O)n(C)c1=O
InchiKey: ZFXYFBGIUFBOJW-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)
50440 BRD-K97799481 HCC515 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
52219 BRD-K97799481 MCF??7.00 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
52756 BRD-K97799481 HEPG2 4 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
90904 BRD-K97799481 HUH7 20 uM 72 h 0.0 0.0 0.0 0.0 0.0 0.0
127337 BRD-K97799481 A375 0.37 uM 24 h 0.0 0.0 0.0 -0.23 -0.76 0.07
127382 BRD-K97799481 A549 0.04 uM 24 h 0.0 0.0 0.0 0.33 1.16 0.91
127411 BRD-K97799481 HA1E 3.33 uM 24 h 0.0 0.0 0.0 -0.23 -0.76 0.07
127498 BRD-K97799481 JURKAT 0.37 uM 24 h -0.25 -1.04 0.21 0.0 0.0 0.0
127592 BRD-K97799481 PC3 0.125 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
127635 BRD-K97799481 THP1 1.11 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
127668 BRD-K97799481 YAPC 10 uM 24 h 0.0 0.0 0.0 0.31 1.09 0.68
135359 BRD-K97799481 HELA 2.22 uM 24 h 0.0 0.0 0.0 -0.37 -1.26 1.35
135388 BRD-K97799481 HT29 0.25 uM 24 h 0.0 0.0 0.0 -0.28 -0.93 0.34
135428 BRD-K97799481 MCF10A 0.74 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).