CMap Candidate Details

Structure:
CMap ID: C00258
Pert ID: BRD-A10012892
Compound Name: argatroban
Targets: F2
MoA: Thrombin inhibitor
SMILES: C[C@@H]1CCN([C@@H](C1)C(O)=O)C(=O)[C@H](CCCNC(N)=N)NS(=O)(=O)c1cccc2CC(C)CNc12
InchiKey: KXNPVXPOPUZYGB-YZYLHUITSA-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)
121193 BRD-A10012892 A549 3.33 uM 24 h 0.26 1.08 0.22 -0.32 -1.06 0.73
121226 BRD-A10012892 HA1E 1.11 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
121322 BRD-A10012892 PC3 0.125 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
121352 BRD-A10012892 YAPC 0.04 uM 24 h 0.23 0.96 0.08 -0.28 -0.93 0.34
129248 BRD-A10012892 A375 0.08 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
129277 BRD-A10012892 HELA 0.08 uM 3 h 0.0 0.0 0.0 0.0 0.0 0.0
129305 BRD-A10012892 HT29 0.08 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
129340 BRD-A10012892 MCF??7.00 0.03 uM 24 h -0.31 -1.3 0.82 -0.31 -1.04 0.68
The GSE89632 and GSE126848 datasets are hepatic gene expression profiles of nonalcoholic fatty liver disease (NAFLD).