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CMap Candidate Details

Structure:
CMap ID: C04354
Pert ID: BRD-A74914197
Compound Name: pralatrexate
Targets: DHFR|TYMS
MoA: dihydrofolate reductase inhibitor
SMILES: Nc1nc(N)c2nc(CC(CC#C)c3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2n1
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)
127040 BRD-A74914197 HA1E 3.33 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
127132 BRD-A74914197 HT29 1.11 uM 24 h 0.0 0.0 0.0 0.26 0.93 0.27
127308 BRD-A74914197 YAPC 1.11 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
135014 BRD-A74914197 A375 0.25 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
135036 BRD-A74914197 A549 0.08 uM 24 h 0.28 1.16 0.36 0.0 0.0 0.0
135102 BRD-A74914197 HEK293 0.74 uM 24 h 0.27 1.12 0.27 -0.31 -1.03 0.64
135127 BRD-A74914197 HELA 0.08 uM 24 h 0.0 0.0 0.0 -0.22 -0.74 0.06
135166 BRD-A74914197 JURKAT 2.22 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
135201 BRD-A74914197 MCF10A 0.74 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
135226 BRD-A74914197 MCF??7.00 0.74 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
135255 BRD-A74914197 MDAMB231 0.03 uM 24 h 0.0 0.0 0.0 0.27 0.95 0.31
135297 BRD-A74914197 PC3 0.08 uM 24 h 0.0 0.0 0.0 -0.45 -1.51 15.35
135304 BRD-A74914197 THP1 0.01 uM 24 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).