SCHEMBL12824713 — predicted protein targets

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	SMO	Q99835	1/20	0.43

▸	DYRK1A	Q13627	15/20	0.40

▸	WNT1	P04628	12/20	0.40

▸	EPHX2	P34913	1/20	0.39

▸	KCNH2	Q12809	1/20	0.38

▸	SCN5A	Q14524	1/20	0.38

▸	SCN9A	Q15858	1/20	0.38

▸	CDK9	P50750	1/20	0.37

▸	JAK2	O60674	1/20	0.36

▸	JAK1	P23458	1/20	0.36

▸	JAK3	P52333	1/20	0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compound	similarity	top predicted	shared targets
SCHEMBL12825019	0.93	SMO (0.44)	SMODYRK1AWNT1EPHX2KCNH2
SCHEMBL12825022	0.90	SMO (0.43)	SMODYRK1AEPHX2CDK9JAK2
SCHEMBL12824720	0.90	SMO (0.44)	SMOEPHX2CDK9JAK2JAK1
SCHEMBL12824862	0.90	SMO (0.44)	SMOEPHX2CDK9JAK2JAK1
SCHEMBL12825055	0.90	SMO (0.44)	SMOEPHX2
SCHEMBL12825057	0.90	SMO (0.44)	SMOEPHX2JAK2JAK1JAK3
SCHEMBL12824616	0.89	SMO (0.43)	SMOEPHX2
SCHEMBL12824615	0.89	SMO (0.44)	SMOEPHX2
SCHEMBL12824858	0.89	SMO (0.45)	SMODYRK1AWNT1EPHX2JAK2
SCHEMBL12824594	0.89	SMO (0.43)	SMOEPHX2CDK9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
WO-2011024869-A1	FUSED HETEROCYCLIC RING DERIVATIVE AND USE THEREOF	武田薬品工業株式会社 (JP)	2011-03-03	—	—	WO	disclosed