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CMap Candidate Details

Structure:
CMap ID: C04780
Pert ID: BRD-K09963420
Compound Name: saquinavir
Targets: CYP3A4
MoA: HIV protease inhibitor
SMILES: CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccc2ccccc2n1
InchiKey:
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)
1738 BRD-K09963420 HA1E 10 uM 6 h -0.19 -0.78 0.0 0.0 0.0 0.0
1883 BRD-K09963420 HCC515 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
24408 BRD-K09963420 A375 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
24652 BRD-K09963420 A549 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
25083 BRD-K09963420 MCF??7.00 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
25233 BRD-K09963420 PC3 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
25327 BRD-K09963420 VCAP 10 uM 24 h -0.26 -1.07 0.28 0.22 0.79 0.07
42290 BRD-K09963420 ASC 10 uM 24 h 0.0 0.0 0.0 -0.29 -0.98 0.48
42623 BRD-K09963420 HEPG2 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
42925 BRD-K09963420 HT29 10 uM 6 h 0.0 0.0 0.0 0.0 0.0 0.0
43483 BRD-K09963420 NPC 10 uM 24 h 0.0 0.0 0.0 -0.29 -0.96 0.44
100059 BRD-K09963420 U2OS 2.5 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).