SCHEMBL31317827 — predicted protein targets

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	CA1	P00915	1/20	0.59

▸	CA2	P00918	1/20	0.59

▸	CTSK	P43235	2/20	0.57

▸	BTK	Q06187	2/20	0.50

▸	HSD11B1	P28845	6/20	0.45

▸	CYP2C9	P11712	1/20	0.45

▸	JAK3	P52333	1/20	0.44

▸	MAP4K4	O95819	2/20	0.43

▸	GAA	P10253	1/20	0.43

▸	EPHX1	P07099	2/20	0.42

▸	KMT2A	Q03164	1/20	0.40

▸	L3MBTL1	Q9Y468	1/20	0.40

▸	PDE10A	Q9Y233	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
SCHEMBL17951138	1.00	CA1 (0.59)	CA1CA2CTSKBTKHSD11B1
SCHEMBL31317808	1.00	CA1 (0.59)	CA1CA2CTSKBTKHSD11B1
SCHEMBL23119939	0.91	CTSK (0.59)	CA1CA2CTSKBTKHSD11B1
SCHEMBL28830472	0.91	CTSK (0.59)	CA1CA2CTSKBTKHSD11B1
SCHEMBL28830439	0.91	CTSK (0.59)	CA1CA2CTSKBTKHSD11B1
SCHEMBL28830425	0.85	CTSK (0.50)	CA1CA2CTSKBTKHSD11B1
SCHEMBL21882076	0.82	CTSK (0.55)	CA1CA2CTSKBTKHSD11B1
SCHEMBL22199009	0.81	CA1 (0.60)	CA1CA2CTSKBTKHSD11B1
SCHEMBL12440607	0.81	CA1 (0.63)	CA1CA2CTSKBTKHSD11B1
SCHEMBL24476884	0.81	CA1 (0.63)	CA1CA2CTSKBTKHSD11B1

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-2025011633-A1	ANTAGONIST OF MAS-RELATED G PROTEIN-COUPLED RECEPTOR X2 AND USE THEREOF	北京普祺医药科技股份有限公司	2025-01-16	—	—	WO	disclosed