M.Wt: 416.58
Formula: C₂₀H₂₀N₂O₂S₃
Smiles: O=C1N(CC(C)=C)C(SCC(C2=CC=CS2)=O)=NC3=C1C4=C(S3)CCCC4

Phenotype

SwissADME

 

 

 

Confirmed Pathway Activity

Antagonist

Hedgehog signaling (IC50): 1.34 uM

 

Confirmed Targets

PDE4D (IC₅₀ = 0.38 uM)

 

Additional Information

Publications

Williams CH, Hempel JE, Hao J, Frist AY, Williams MM, Fleming JT, Sulikowski GA, Cooper MK, Chiang C, Hong CC. An in vivo chemical genetic screen identifies phosphodiesterase 4 as a pharmacological target for hedgehog signaling inhibition. Cell reports. 2015 Apr 7;11(1). 43-50.

Citations: 14

Hempel JE, Cadar AG, Hong CC. Development of thieno- and benzopyrimidinone inhibitors of the Hedgehog signaling pathway reveals PDE4-dependent and PDE4-independent mechanisms of action. Bioorganic & medicinal chemistry letters. 2016 Mar 7.

Citations: 1

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