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CMap Candidate Details

Structure:
CMap ID: C00143
Pert ID: BRD-K04691817
Compound Name: AGI-6780
Targets: IDH2
MoA: isocitrate dehydrogenase inhibitor
SMILES: FC(F)(F)c1cccc(NC(=O)Nc2cc(ccc2-c2ccsc2)S(=O)(=O)NC2CC2)c1
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)
122563 BRD-K04691817 A549 1.11 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
122619 BRD-K04691817 HEK293 3.33 uM 24 h 0.0 0.0 0.0 -0.4 -1.36 2.02
122669 BRD-K04691817 HT29 10 uM 24 h 0.0 0.0 0.0 -0.37 -1.23 1.29
122698 BRD-K04691817 MCF10A 0.04 uM 24 h -0.21 -0.88 0.03 0.0 0.0 0.0
130857 BRD-K04691817 A375 0.01 uM 24 h 0.29 1.2 0.42 0.32 1.12 0.74
130899 BRD-K04691817 HA1E 0.74 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
130950 BRD-K04691817 HELA 0.25 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
131019 BRD-K04691817 HUVEC 0.25 uM 24 h -0.21 -0.88 0.03 0.0 0.0 0.0
131072 BRD-K04691817 MCF??7.00 0.74 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
131104 BRD-K04691817 MDAMB231 0.03 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
131138 BRD-K04691817 PC3 0.25 uM 24 h 0.22 0.92 0.04 0.0 0.0 0.0
131168 BRD-K04691817 YAPC 0.08 uM 24 h 0.21 0.86 0.01 0.0 0.0 0.0
The GSE89632 and GSE126848 datasets are hepatic gene expression profiles of nonalcoholic fatty liver disease (NAFLD).