SCHEMBL6497780 — predicted protein targets

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	ITGAL	P20701	9/20	0.52

▸	ITGB2	P05107	8/20	0.52

▸	ICAM1	P05362	8/20	0.52

▸	CAPN1	P07384	4/20	0.45

▸	KMT2A	Q03164	3/20	0.44

▸	MEN1	O00255	2/20	0.40

▸	ALDH1A1	P00352	1/20	0.39

▸	NPC1	O15118	2/20	0.37

▸	RAB9A	P51151	2/20	0.37

▸	SMN1; SMN2	Q16637	1/20	0.36

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
SCHEMBL6498278	1.00	ITGAL (0.52)	ITGALITGB2ICAM1CAPN1KMT2A
SCHEMBL8297625	1.00	ITGAL (0.52)	ITGALITGB2ICAM1CAPN1KMT2A
SCHEMBL6505218	0.92	ITGAL (0.49)	ITGALITGB2ICAM1CAPN1KMT2A
SCHEMBL6505214	0.92	ITGAL (0.49)	ITGALITGB2ICAM1CAPN1KMT2A
SCHEMBL6498184	0.91	ITGAL (0.55)	ITGALITGB2ICAM1CAPN1KMT2A
SCHEMBL6498187	0.91	ITGAL (0.55)	ITGALITGB2ICAM1CAPN1KMT2A
SCHEMBL8296138	0.91	ITGAL (0.55)	ITGALITGB2ICAM1CAPN1KMT2A
SCHEMBL6499198	0.89	CAPN1 (0.53)	ITGALITGB2ICAM1CAPN1KMT2A
SCHEMBL8296816	0.89	CAPN1 (0.53)	ITGALITGB2ICAM1CAPN1KMT2A
SCHEMBL6499199	0.89	CAPN1 (0.53)	ITGALITGB2ICAM1CAPN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
WO-2005016883-A2	ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF	ICOS CORPORATION (US)	2005-02-24	—	—	WO	claimed
WO-2005016883-A2	ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF	ICOS CORPORATION (US)	2005-02-24	—	—	WO	disclosed