SCHEMBL13502552 — predicted protein targets

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	GRIN1	Q05586	1/20	0.37

▸	GRIN2A	Q12879	1/20	0.37

▸	CHRM2	P08172	9/20	0.37

▸	CHRM4	P08173	9/20	0.37

▸	CHRM5	P08912	9/20	0.37

▸	CHRM1	P11229	9/20	0.37

▸	CHRM3	P20309	9/20	0.37

▸	ADRA1A	P35348	3/20	0.37

▸	HTR1A	P08908	2/20	0.37

▸	ADRA1D	P25100	1/20	0.37

▸	ADRA1B	P35368	1/20	0.37

▸	GAA	P10253	1/20	0.37

▸	HSD17B10	Q99714	1/20	0.37

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
SCHEMBL13502557	0.86	MAOA (0.34)	—
SCHEMBL13502553	0.83	HSP90AA1 (0.36)	—
SCHEMBL11448804	0.81	ADRA1A (0.54)	ADRA1AHTR1AADRA1DADRA1BGAA
SCHEMBL19939756	0.78	CHRM2 (0.42)	CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL12132801	0.78	GRIN1 (0.37)	GRIN1GRIN2ACHRM2CHRM4CHRM5
SCHEMBL12662787	0.78	GRIN1 (0.36)	GRIN1GRIN2ACHRM2CHRM4CHRM5
SCHEMBL12132845	0.78	GRIN1 (0.37)	GRIN1GRIN2ACHRM2CHRM4CHRM5
SCHEMBL12132844	0.78	GRIN1 (0.37)	GRIN1GRIN2ACHRM2CHRM4CHRM5
SCHEMBL12132792	0.76	GRIN1 (0.36)	GRIN1GRIN2ACHRM2CHRM4CHRM5
SCHEMBL12662845	0.76	GRIN1 (0.36)	GRIN1GRIN2ACHRM2CHRM4CHRM5

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-2010013510-A1	PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE COMPOUND	ダイソー株式会社 (JP)	2010-02-04	—	—	WO	disclosed