SCHEMBL28501455 — predicted protein targets

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	ELANE	P08246	1/20	0.48

▸	RAB9A	P51151	2/20	0.47

▸	GAA	P10253	1/20	0.47

▸	MMP8	P22894	1/20	0.46

▸	ALDH1A1	P00352	3/20	0.46

▸	KMT2A	Q03164	3/20	0.46

▸	MEN1	O00255	2/20	0.46

▸	NPC1	O15118	1/20	0.45

▸	TP53	P04637	1/20	0.44

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
SCHEMBL28501453	1.00	ELANE (0.48)	ELANERAB9AGAAMMP8ALDH1A1
SCHEMBL23211250	0.93	ALDH1A1 (0.49)	ELANERAB9AGAAALDH1A1KMT2A
SCHEMBL5276866	0.90	ALDH1A1 (0.50)	RAB9AGAAALDH1A1KMT2AMEN1
SCHEMBL5276860	0.90	ALDH1A1 (0.50)	RAB9AGAAALDH1A1KMT2AMEN1
SCHEMBL4428836	0.86	ALDH1A1 (0.47)	RAB9AGAAALDH1A1KMT2AMEN1
SCHEMBL6615901	0.84	RAB9A (0.53)	RAB9AGAAALDH1A1KMT2AMEN1
SCHEMBL6615905	0.84	RAB9A (0.53)	RAB9AGAAALDH1A1KMT2AMEN1
SCHEMBL21411145	0.83	ALDH1A1 (0.46)	RAB9AGAAALDH1A1KMT2AMEN1
SCHEMBL21410862	0.82	ALDH1A1 (0.45)	RAB9AALDH1A1KMT2AMEN1NPC1
SCHEMBL8883935	0.82	L3MBTL1 (0.46)	GAAALDH1A1KMT2AMEN1TP53

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
CN-112165940-A	OX2R compound	德克萨斯州立大学董事会	2021-01-01	—	—	CN	disclosed