CMap Candidate Details

Structure:
CMap ID: C01982
Pert ID: BRD-A81177136
Compound Name: KN-62
Targets: P2RX7; CAMK2A
MoA: Purinergic receptor antagonist; Calcium/calmodulin dependent protein kinase inhibitor
SMILES: CN(C(Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1)C(=O)N4CCN(CC4)c5ccccc5)S(=O)(=O)c6cccc7cnccc67
InchiKey: RJVLFQBBRSMWHX-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)
1513 BRD-A81177136 HA1E 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
1846 BRD-A81177136 HCC515 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
2209 BRD-A81177136 PC3 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
2512 BRD-A81177136 VCAP 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
42237 BRD-A81177136 ASC 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
42578 BRD-A81177136 HEPG2 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
42883 BRD-A81177136 HT29 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
43744 BRD-A81177136 PHH 10 uM 24 h 0.3 1.25 0.53 0.0 0.0 0.0
44030 BRD-A81177136 SKB 10 uM 24 h 0.24 1.0 0.11 0.25 0.89 0.2
95765 BRD-A81177136 A375 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
95788 BRD-A81177136 MCF??7.00 10 uM 6 h 0.0 0.0 0.0 0.34 1.2 1.11
95802 BRD-A81177136 NPC 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
95900 BRD-A81177136 YAPC 10 uM 6 h 0.0 0.0 0.0 0.33 1.15 0.9
96097 BRD-A81177136 A549 10 uM 24 h 0.0 0.0 0.0 -0.23 -0.77 0.08
100344 BRD-A81177136 U2OS 10 uM 6 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).