SCHEMBL19086315 — predicted protein targets

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	KDM1A	O60341	4/20	0.47

▸	NAMPT	P43490	1/20	0.42

▸	HDAC6	Q9UBN7	3/20	0.42

▸	PRMT5	O14744	10/20	0.42

▸	WDR77	Q9BQA1	10/20	0.42

▸	GAA	P10253	2/20	0.40

▸	TP53	P04637	1/20	0.40

▸	MAPT	P10636	1/20	0.40

▸	RAB9A	P51151	1/20	0.40

▸	HPGD	P15428	1/20	0.39

▸	NPC1	O15118	1/20	0.39

▸	ALDH1A1	P00352	1/20	0.39

▸	L3MBTL1	Q9Y468	1/20	0.39

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
SCHEMBL19087010	0.89	KDM1A (0.41)	KDM1AHDAC6PRMT5WDR77ALDH1A1
SCHEMBL19086245	0.84	HDAC6 (0.43)	KDM1AHDAC6PRMT5WDR77ALDH1A1
SCHEMBL19086189	0.84	PRMT5 (0.48)	KDM1AHDAC6PRMT5WDR77ALDH1A1
SCHEMBL19087005	0.83	KDM1A (0.41)	KDM1AHDAC6PRMT5WDR77ALDH1A1
SCHEMBL19086202	0.83	KDM1A (0.48)	KDM1AHDAC6PRMT5WDR77TP53
SCHEMBL19086203	0.82	PRMT5 (0.40)	KDM1ANAMPTHDAC6PRMT5WDR77
SCHEMBL19086204	0.81	ALDH1A1 (0.43)	KDM1AHDAC6PRMT5WDR77RAB9A
SCHEMBL19086019	0.81	ALDH1A1 (0.41)	KDM1AHDAC6PRMT5WDR77RAB9A
SCHEMBL19086238	0.80	EPHX2 (0.42)	KDM1AHDAC6PRMT5WDR77ALDH1A1
SCHEMBL19086218	0.79	KDM1A (0.48)	KDM1AHDAC6PRMT5WDR77MAPT

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