SCHEMBL7939313 — predicted protein targets

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	BRD4	O60885	1/20	0.36

▸	ROCK2	O75116	12/20	0.36

▸	CLK1	P49759	1/20	0.36

▸	HIPK2	Q9H2X6	1/20	0.36

▸	CLK4	Q9HAZ1	1/20	0.36

▸	MTOR	P42345	2/20	0.34

▸	HTR6	P50406	2/20	0.34

▸	FFAR2	O15552	1/20	0.33

▸	AKT1	P31749	1/20	0.33

▸	AKT2	P31751	1/20	0.33

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
SCHEMBL2277123	0.84	TYRO3 (0.39)	BRD4
SCHEMBL16374566	0.81	ROCK2 (0.40)	BRD4ROCK2MTORHTR6
SCHEMBL8169943	0.81	ROCK2 (0.40)	BRD4ROCK2MTORHTR6
SCHEMBL7940303	0.74	ROCK2 (0.35)	BRD4ROCK2MTORHTR6
SCHEMBL16374480	0.73	KDM4E (0.40)	BRD4ROCK2HTR6
SCHEMBL3348822	0.73	HTR6 (0.40)	BRD4HTR6
SCHEMBL16374478	0.72	BRD4 (0.39)	BRD4ROCK2HTR6
SCHEMBL2752372	0.72	PIK3CA (0.38)	BRD4ROCK2HTR6
SCHEMBL16374610	0.71	KDM4E (0.39)	BRD4ROCK2HTR6
SCHEMBL2752527	0.71	HTR6 (0.41)	BRD4ROCK2HIPK2CLK4HTR6

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-2010015803-A1	DIAZAINDOLE DERIVATIVES AND THEIR USE IN THE INHIBITION OF C-JUN N-TERMINAL KINASE	EISAI R & D MANAGEMENT CO. LTD (JP)	2010-02-11	—	—	WO	disclosed