CMap Candidate Details

Structure:
CMap ID: C18522
Pert ID: BRD-K50498985
Compound Name: taladegib
Targets: IHH; DHH; SMO
MoA: Smoothened receptor antagonist
SMILES: CN(C1CCN(CC1)c1nnc(-c2ccnn2C)c2ccccc12)C(=O)c1ccc(F)cc1C(F)(F)F
InchiKey: SZBGQDXLNMELTB-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)
95663 BRD-K50498985 U2OS 0.12 uM 48 h 0.0 0.0 0.0 0.0 0.0 0.0
118696 BRD-K50498985 A375 0.04 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
118730 BRD-K50498985 A549 0.04 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
118807 BRD-K50498985 HCC515 10 uM 24 h -0.23 -0.95 0.09 -0.3 -1.02 0.59
118849 BRD-K50498985 HEPG2 10 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
125340 BRD-K50498985 HEK293 0.125 uM 24 h 0.21 0.89 0.02 0.43 1.52 2.28
125361 BRD-K50498985 HELA 0.125 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
125466 BRD-K50498985 MCF??7.00 0.125 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
125478 BRD-K50498985 MDAMB231 0.37 uM 24 h 0.0 0.0 0.0 -0.3 -1.0 0.55
125507 BRD-K50498985 PC3 1.11 uM 24 h -0.22 -0.92 0.06 0.35 1.24 1.25
133405 BRD-K50498985 HA1E 0.01 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
133469 BRD-K50498985 HT29 0.25 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
133498 BRD-K50498985 JURKAT 0.25 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
133532 BRD-K50498985 MCF10A 0.08 uM 24 h 0.0 0.0 0.0 0.0 0.0 0.0
133617 BRD-K50498985 THP1 0.74 uM 24 h 0.21 0.86 0.01 0.0 0.0 0.0
133651 BRD-K50498985 YAPC 0.08 uM 24 h 0.33 1.39 1.02 0.0 0.0 0.0
The GSE89632 and GSE126848 datasets are hepatic gene expression profiles of nonalcoholic fatty liver disease (NAFLD).