CMap Candidate Details

Structure:
CMap ID: C02003
Pert ID: BRD-A81866333
Compound Name: CGS-21680
Targets: ADORA1; ADORA2A
MoA: Adenosine receptor agonist
SMILES: CCNC(=O)C1OC(C(O)C1O)n2cnc3c(N)nc(NCCc4ccc(CCC(=O)O)cc4)nc23
InchiKey: PAOANWZGLPPROA-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)
1198 BRD-A81866333 PC3 0.12 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
1238 BRD-A81866333 A549 0.12 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
1312 BRD-A81866333 MCF??7.00 0.12 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
1410 BRD-A81866333 U2OS 0.12 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
1515 BRD-A81866333 HA1E 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
1848 BRD-A81866333 HCC515 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
2738 BRD-A81866333 VCAP 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
39070 BRD-A81866333 A375 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
39598 BRD-A81866333 ASC 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
39917 BRD-A81866333 HEPG2 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
40202 BRD-A81866333 HT29 10 uM 6 h 0.0 0.0 0.0 -0.39 -1.3 1.58
40721 BRD-A81866333 NEU 10 uM 24 h -0.26 -1.09 0.31 0.0 0.0 0.0
41022 BRD-A81866333 NPC 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
41345 BRD-A81866333 SKB 10 uM 24 h 0.0 0.0 0.0 -0.24 -0.81 0.14
The GSE89632 and GSE126848 datasets are hepatic gene expression profiles of nonalcoholic fatty liver disease (NAFLD).