CMap Candidate Details

Structure:
CMap ID: C02348
Pert ID: BRD-A97502381
Compound Name: cyanocobalamin
Targets: MMUT
MoA: Vitamin B; Methylmalonyl CoA mutase stimulant
SMILES: C[C@H](CNC(=O)CC[C@]1(C)[C@@H](CC(N)=O)[C@@H]2[N+]3=C1C(C)=C1[C@@H](CCC(N)=O)C(C)(C)C4=[N+]1[Co]31(C#N)N3C([C@@H](CCC(N)=O)[C@](C)(CC(N)=O)[C@]23C)=C(C)C2=[N+]1C(=C4)[C@@H](CCC(N)=O)[C@]2(C)CC(N)=O)OP(O)(=O)O[C@@H]1[C@H](CO)O[C@@H]([C@@H]1O)n1cnc2cc(C)c(C)cc12
InchiKey: FMCRMSOQAVOHRD-SBGISONWSA-M
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)
128405 BRD-A97502381 A549 0.37 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128412 BRD-A97502381 HA1E 0.04 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128467 BRD-A97502381 HEK293 1.11 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128521 BRD-A97502381 HT29 0.04 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128577 BRD-A97502381 JURKAT 0.125 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128669 BRD-A97502381 MDAMB231 0.04 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128695 BRD-A97502381 PC3 0.04 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128748 BRD-A97502381 THP1 0.04 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
128787 BRD-A97502381 YAPC 0.125 uM 24 h 0.22 0.92 0.04 0.32 1.13 0.8
136203 BRD-A97502381 A375 0.74 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
136279 BRD-A97502381 HELA 0.03 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
136326 BRD-A97502381 MCF10A 0.74 uM 24 h 0.0 0.0 0.0 0.22 0.78 0.07
136355 BRD-A97502381 MCF??7.00 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).