SCHEMBL19086045 — predicted protein targets

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	HDAC6	Q9UBN7	3/20	0.43

▸	ROCK2	O75116	8/20	0.42

▸	ROCK1	Q13464	2/20	0.42

▸	NPC1	O15118	2/20	0.40

▸	RAB9A	P51151	2/20	0.40

▸	MAPK14	Q16539	1/20	0.40

▸	RPS6KB1	P23443	1/20	0.40

▸	STAT6	P42226	2/20	0.37

▸	STAT5A	P42229	1/20	0.37

▸	CYP3A4	P08684	1/20	0.37

▸	AKT1	P31749	1/20	0.36

▸	PRNP	P04156	1/20	0.36

▸	HRH3	Q9Y5N1	1/20	0.35

▸	PRMT5	O14744	1/20	0.35

▸	WDR77	Q9BQA1	1/20	0.35

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
SCHEMBL19086047	0.88	ROCK2 (0.44)	HDAC6ROCK2ROCK1NPC1RAB9A
SCHEMBL19086020	0.88	ROCK2 (0.44)	HDAC6ROCK2ROCK1NPC1RAB9A
SCHEMBL19086141	0.86	ROCK2 (0.44)	HDAC6ROCK2ROCK1NPC1RAB9A
SCHEMBL19086995	0.83	ROCK2 (0.47)	HDAC6ROCK2ROCK1NPC1RAB9A
SCHEMBL19086052	0.83	ROCK2 (0.46)	HDAC6ROCK2ROCK1MAPK14RPS6KB1
SCHEMBL19086056	0.82	ROCK2 (0.43)	HDAC6ROCK2ROCK1MAPK14RPS6KB1
SCHEMBL19086049	0.81	ROCK2 (0.43)	HDAC6ROCK2ROCK1MAPK14RPS6KB1
SCHEMBL19086051	0.81	ROCK2 (0.48)	HDAC6ROCK2ROCK1MAPK14RPS6KB1
SCHEMBL19086055	0.81	ROCK2 (0.40)	HDAC6ROCK2ROCK1MAPK14CYP3A4
SCHEMBL19086000	0.81	KDM4E (0.39)	HDAC6NPC1RAB9A

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-2017114275-A1	COMPOUND FOR INHIBITING ROCK, PREPARATION METHOD AND USE OF SAME	成都先导药物开发有限公司	2017-07-06	—	—	WO	disclosed