M Wt. 287
Formula: C₁₅H₁₇N₃OS
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Phenotype

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Descriptor

Anatomical Features BAI8462

Axis	Reduced length, Curved ventrally
Blood	Absent
Blood circulation	Absent
Brain	Normal
Cloaca	Absent
Eye	Normal
Eye pigmentation	Absent
Forebrain	Reduced size
Fourth ventricle	Reduced size
Head	Reduced size
Heart	Reduced size
Heart contraction	Abnormal, bradycardia
Locomotion	Movement-loss
Melanocyte	Absent
Midbrain hindbrain boundary	Present
Notochord	Reduced length
Otic placode	Reduced size
Otolith	Normal
Pericardium	Swollen
Post-vent region	Reduced size
Somite	Abnormal
Third Ventricle	Normal
Trunk	Normal
Tail	Reduced length
Whole organism	Abnormal color, reduced length
Yolk	Increased size

Cheminformatics

Molinspiration

GPCR ligand                   -0.37
Ion channel modulator    -0.83
Kinase inhibitor               -0.47
Nuclear receptor ligand  -1.13
Protease inhibitor            -0.68
Enzyme inhibitor             -0.24

ChemProt TC>0.95

SMAD 3 =0.56

Lasso

Category	Target	PDB ID	Score
Metalloenzymes	ACE, angiotensin-converting enzyme	1o86	0.03
Nuclear Hormone Receptors	PPARg, peroxisome proliferator activated receptor	1fm9	0.03
Serine Proteases	FXa, factor Xa	1f0r	0.02

 Confirmed Pathway

 

Confirmed Target

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