CMap Candidate Details

Structure:
CMap ID: C20574
Pert ID: BRD-K57041787
Compound Name: dabigatran-etexilate
Targets: F2
MoA: Thrombin inhibitor; Serine protease inhibitor
SMILES: CCCCCCOC(=O)N=C(N)c1ccc(NCc2nc3cc(ccc3n2C)C(=O)N(CCC(=O)OCC)c2ccccn2)cc1
InchiKey: KSGXQBZTULBEEQ-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)
123793 BRD-K57041787 A375 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
123835 BRD-K57041787 A549 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
123869 BRD-K57041787 HA1E 10 uM 24 h 0.0 0.0 0.0 0.35 1.22 1.18
123897 BRD-K57041787 HEK293 0.04 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
123941 BRD-K57041787 HELA 1.11 uM 24 h 0.0 0.0 0.0 -0.27 -0.89 0.27
123962 BRD-K57041787 HT29 1.11 uM 24 h 0.0 0.0 0.0 0.25 0.89 0.2
123997 BRD-K57041787 JURKAT 0.125 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
124050 BRD-K57041787 MCF10A 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
124094 BRD-K57041787 MCF??7.00 0.125 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
124121 BRD-K57041787 MDAMB231 10 uM 24 h 0.0 0.0 0.0 0.32 1.12 0.76
124152 BRD-K57041787 PC3 10 uM 24 h 0.35 1.47 1.12 0.0 0.0 0.0
124179 BRD-K57041787 THP1 1.11 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
124232 BRD-K57041787 YAPC 10 uM 24 h 0.3 1.24 0.53 0.0 0.0 0.0
The GSE89632 and GSE126848 datasets are hepatic gene expression profiles of nonalcoholic fatty liver disease (NAFLD).