SCHEMBL25867432 — predicted protein targets

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	CHRNA1	P02708	2/20	0.33

▸	CHRNG	P07510	2/20	0.33

▸	CHRNB1	P11230	2/20	0.33

▸	CHRNB2	P17787	2/20	0.33

▸	SLC6A2	P23975	2/20	0.33

▸	CHRNB4	P30926	2/20	0.33

▸	SLC6A4	P31645	2/20	0.33

▸	CHRNA3	P32297	2/20	0.33

▸	CHRNA4	P43681	2/20	0.33

▸	SLC6A3	Q01959	2/20	0.33

▸	CHRND	Q07001	2/20	0.33

▸	PDK2	Q15119	2/20	0.31

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
SCHEMBL25858411	0.95	PDK2 (0.32)	PDK2
SCHEMBL25858859	0.94	CHRNA1 (0.33)	CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
SCHEMBL25867482	0.94	—	—
SCHEMBL25858973	0.91	CHRNA1 (0.32)	CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
SCHEMBL25858969	0.91	PDK2 (0.33)	CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
SCHEMBL25859037	0.91	PDK2 (0.33)	CHRNA1CHRNGCHRNB1CHRNB2SLC6A2
SCHEMBL25871493	0.90	PDK2 (0.33)	PDK2
SCHEMBL25850632	0.90	PDK2 (0.32)	PDK2
SCHEMBL25858413	0.89	CA12 (0.30)	—
SCHEMBL25858857	0.89	CHRNA1 (0.35)	CHRNA1CHRNGCHRNB1CHRNB2SLC6A2

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-2023120714-A1	COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE	出光興産株式会社	2023-06-29	—	—	WO	disclosed