SCHEMBL23978733 — predicted protein targets

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	ITGB2	P05107	13/20	0.37

▸	ICAM1	P05362	13/20	0.37

▸	ITGAL	P20701	13/20	0.37

▸	SMN1; SMN2	Q16637	3/20	0.35

▸	ALDH1A1	P00352	2/20	0.35

▸	TDP1	Q9NUW8	2/20	0.35

▸	PKM	P14618	1/20	0.35

▸	LMNA	P02545	1/20	0.34

▸	L3MBTL1	Q9Y468	1/20	0.34

▸	NCOA3	Q9Y6Q9	1/20	0.34

▸	MEN1	O00255	1/20	0.34

▸	KMT2A	Q03164	1/20	0.34

▸	HRH1	P35367	1/20	0.34

▸	MAPT	P10636	1/20	0.34

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
SCHEMBL24804232	0.90	EPHX2 (0.40)	ITGB2ICAM1ITGALSMN1; SMN2
SCHEMBL30083854	0.90	EPHX2 (0.40)	ITGB2ICAM1ITGALSMN1; SMN2
SCHEMBL26477771	0.90	EPHX2 (0.40)	ITGB2ICAM1ITGALSMN1; SMN2
SCHEMBL24804736	0.89	ITGB2 (0.40)	ITGB2ICAM1ITGAL
SCHEMBL30083823	0.89	ITGB2 (0.40)	ITGB2ICAM1ITGAL
SCHEMBL24804737	0.89	ITGB2 (0.40)	ITGB2ICAM1ITGAL
SCHEMBL30083832	0.86	EPHX2 (0.37)	ITGB2ICAM1ITGAL
SCHEMBL24803447	0.86	EPHX2 (0.37)	ITGB2ICAM1ITGAL
SCHEMBL24804916	0.86	EPHX2 (0.37)	ITGB2ICAM1ITGAL
SCHEMBL23978724	0.84	ITGB2 (0.41)	ITGB2ICAM1ITGALSMN1; SMN2ALDH1A1

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-2021222789-A1	INHIBITORS OF ALPHA 2 BETA 1 INTEGRIN AND METHODS OF USE THEREOF	THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US)	2021-11-04	—	—	WO	disclosed