SCHEMBL22861972 — predicted protein targets

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	CA2	P00918	7/20	0.39

▸	CA1	P00915	4/20	0.39

▸	MAPK1	P28482	1/20	0.38

▸	SLC1A2	P43004	2/20	0.37

▸	SLC1A1	P43005	2/20	0.37

▸	SLC1A3	P43003	1/20	0.37

▸	PDF	Q9HBH1	4/20	0.34

▸	GRIK1	P39086	2/20	0.33

▸	GRIK2	Q13002	2/20	0.33

▸	ALDH1A1	P00352	1/20	0.32

▸	FDPS	P14324	1/20	0.31

▸	CTSK	P43235	1/20	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
SCHEMBL20849995	0.81	CA2 (0.38)	CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL22995173	0.74	CA2 (0.39)	CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL19993074	0.73	GPR84 (0.48)	CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL20630182	0.73	CA2 (0.50)	CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL26153449	0.73	GRIK1 (0.32)	CA2SLC1A2SLC1A1GRIK1GRIK2
SCHEMBL14297651	0.72	GPR84 (0.52)	CA2SLC1A2SLC1A1GRIK1GRIK2
SCHEMBL8463182	0.71	CA2 (0.46)	CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL10001196	0.70	CA2 (0.61)	CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL14519745	0.70	CA1 (0.48)	CA2CA1MAPK1SLC1A2SLC1A1
SCHEMBL12301666	0.70	CYP2C19 (0.32)	—

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-2021003050-A2	CD38-BINDING AGENTS AND USES THEREOF	KLEO PHARMACEUTICALS, INC. (US)	2021-01-07	—	—	WO	disclosed