CMap Candidate Details

Structure:
CMap ID: C18004
Pert ID: BRD-K48812570
Compound Name: macitentan
Targets: EDNRA; EDNRB
MoA: Endothelin receptor antagonist
SMILES: CCCNS(=O)(=O)Nc1ncnc(OCCOc2ncc(Br)cn2)c1-c1ccc(Br)cc1
InchiKey: JGCMEBMXRHSZKX-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)
96500 BRD-K48812570 A375 3.33 uM 24 h 0.33 1.39 1.02 0.31 1.1 0.69
125622 BRD-K48812570 A549 10 uM 24 h 0.21 0.86 0.01 0.3 1.07 0.63
125685 BRD-K48812570 HELA 0.125 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
125756 BRD-K48812570 HUVEC 10 uM 24 h -0.21 -0.88 0.03 0.0 0.0 0.0
125836 BRD-K48812570 MCF??7.00 1.11 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
125882 BRD-K48812570 PC3 1.11 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
125954 BRD-K48812570 YAPC 0.04 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
133715 BRD-K48812570 HA1E 0.08 uM 24 h 0.24 1.02 0.13 0.0 0.0 0.0
133745 BRD-K48812570 HEK293 0.25 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
133810 BRD-K48812570 HT29 0.74 uM 24 h 0.0 0.0 0.0 0.38 1.34 1.72
133835 BRD-K48812570 JURKAT 0.25 uM 24 h 0.17 0.72 0.0 0.0 0.0 0.0
133870 BRD-K48812570 MCF10A 0.25 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
133928 BRD-K48812570 MDAMB231 0.03 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
133990 BRD-K48812570 THP1 0.25 uM 24 h -0.22 -0.91 0.05 0.3 1.07 0.64
The GSE89632 and GSE126848 datasets are hepatic gene expression profiles of nonalcoholic fatty liver disease (NAFLD).