SCHEMBL25528623 — predicted protein targets

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	ROCK2	O75116	7/20	0.35

▸	ROCK1	Q13464	4/20	0.35

▸	CYP3A4	P08684	1/20	0.35

▸	CYP2D6	P10635	1/20	0.35

▸	PRKAG1	P54619	1/20	0.34

▸	PRKAA2	P54646	1/20	0.34

▸	PRKAB1	Q9Y478	1/20	0.34

▸	F10	P00742	2/20	0.32

▸	PRSS1	P07477	2/20	0.32

▸	F2	P00734	1/20	0.31

▸	KDM4E	B2RXH2	1/20	0.31

▸	TNIK	Q9UKE5	1/20	0.31

▸	BRD4	O60885	1/20	0.30

▸	AGTR2	P50052	1/20	0.30

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
SCHEMBL25528332	0.86	ROCK2 (0.38)	ROCK2ROCK1CYP3A4CYP2D6PRKAG1
SCHEMBL25528328	0.80	BRD4 (0.43)	ROCK2ROCK1CYP3A4BRD4
SCHEMBL25528333	0.78	ROCK2 (0.39)	ROCK2ROCK1BRD4
SCHEMBL25528200	0.78	ROCK2 (0.40)	ROCK2ROCK1
SCHEMBL25528478	0.77	ROCK2 (0.41)	ROCK2ROCK1KDM4EBRD4
SCHEMBL25528201	0.77	ROCK2 (0.39)	ROCK2ROCK1
SCHEMBL25528196	0.76	ROCK2 (0.43)	ROCK2ROCK1BRD4
SCHEMBL25529691	0.75	ROCK2 (0.40)	ROCK2ROCK1BRD4
SCHEMBL25528181	0.74	ROCK2 (0.59)	ROCK2ROCK1CYP3A4TNIK
SCHEMBL25528180	0.74	ROCK2 (0.59)	ROCK2ROCK1CYP3A4TNIK

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-2023093787-A1	BENZODIAZEPINE COMPOUND AND APPLICATION THEREOF AS RHO KINASE INHIBITOR	成都奥睿药业有限公司	2023-06-01	—	—	WO	disclosed