SCHEMBL19086023 — predicted protein targets

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	NAMPT	P43490	2/20	0.38

▸	MAOB	P27338	1/20	0.38

▸	PRMT5	O14744	8/20	0.38

▸	WDR77	Q9BQA1	8/20	0.38

▸	METTL3	Q86U44	1/20	0.38

▸	ALDH1A1	P00352	2/20	0.37

▸	KDM4E	B2RXH2	1/20	0.37

▸	KCNK3	O14649	2/20	0.36

▸	ROCK2	O75116	3/20	0.36

▸	ROCK1	Q13464	1/20	0.36

▸	LMNA	P02545	1/20	0.35

▸	METAP2	P50579	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
SCHEMBL19085994	0.92	ROCK2 (0.41)	NAMPTMAOBPRMT5WDR77METTL3
SCHEMBL19086254	0.91	PRMT5 (0.40)	NAMPTMAOBPRMT5WDR77METTL3
SCHEMBL19086985	0.90	PRMT5 (0.41)	NAMPTMAOBPRMT5WDR77METTL3
SCHEMBL19085984	0.90	ROCK2 (0.42)	MAOBPRMT5WDR77METTL3KDM4E
SCHEMBL19085991	0.89	MAOB (0.42)	NAMPTMAOBPRMT5WDR77METTL3
SCHEMBL19086994	0.89	MAOB (0.39)	NAMPTMAOBPRMT5WDR77METTL3
SCHEMBL19086205	0.89	MAOB (0.39)	NAMPTMAOBPRMT5WDR77METTL3
SCHEMBL19086003	0.88	METTL3 (0.38)	NAMPTMAOBPRMT5WDR77METTL3
SCHEMBL19085997	0.87	PRMT5 (0.40)	NAMPTPRMT5WDR77METTL3ROCK2
SCHEMBL19085992	0.87	PRMT5 (0.40)	NAMPTPRMT5WDR77METTL3ROCK2

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