SCHEMBL12801538 — predicted protein targets

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	TBK1	Q9UHD2	9/20	0.53

▸	CDK1	P06493	1/20	0.50

▸	CDK2	P24941	1/20	0.50

▸	SYK	P43405	9/20	0.47

▸	JAK2	O60674	3/20	0.45

▸	NEK3	P51956	1/20	0.43

▸	LIMK1	P53667	1/20	0.43

▸	NEK5	Q6P3R8	1/20	0.43

▸	MYLK4	Q86YV6	1/20	0.43

▸	STK17A	Q9UEE5	1/20	0.43

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
SCHEMBL12801598	0.90	TBK1 (0.48)	TBK1CDK2JAK2NEK3LIMK1
SCHEMBL12801665	0.90	TBK1 (0.48)	TBK1CDK2JAK2NEK3LIMK1
SCHEMBL12273977	0.89	TBK1 (0.66)	TBK1JAK2
SCHEMBL12801379	0.85	CDC7 (0.51)	TBK1CDK2SYKJAK2NEK3
SCHEMBL12801367	0.85	TBK1 (0.45)	TBK1CDK1CDK2JAK2NEK3
SCHEMBL12801663	0.85	JAK2 (0.59)	TBK1JAK2
SCHEMBL12801252	0.85	JAK2 (0.59)	TBK1JAK2
SCHEMBL12800894	0.84	CDC7 (0.46)	TBK1CDK2SYKJAK2NEK3
SCHEMBL12800954	0.83	JAK2 (0.52)	TBK1SYKJAK2STK17A
SCHEMBL12522355	0.83	TBK1 (0.56)	TBK1JAK2

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-2011046970-A1	AMINO - PYRIMIDINE COMPOUNDS AS INHIBITORS OF TBKL AND/OR IKK EPSILON	MYREXIS, INC. (US)	2011-04-21	—	—	WO	disclosed