SCHEMBL29568917

C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	ITGB3	P05106	1/20	0.48

▸	ITGAV	P06756	1/20	0.48

▸	APLNR	P35414	4/20	0.46

▸	NMBR	P28336	2/20	0.44

▸	GRPR	P30550	2/20	0.44

▸	CALCR	P30988	4/20	0.44

▸	HCRTR1	O43613	1/20	0.44

▸	HCRTR2	O43614	1/20	0.44

▸	F2	P00734	1/20	0.43

▸	C5AR1	P21730	1/20	0.43

▸	CTSL	P07711	1/20	0.42

▸	CTSS	P25774	1/20	0.42

▸	CTSK	P43235	1/20	0.42

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
SCHEMBL29569060	0.89	ITGB3 (0.48)	ITGB3ITGAVAPLNRF2C5AR1
SCHEMBL29568833	0.88	ITGB3 (0.48)	ITGB3ITGAVAPLNRF2C5AR1
SCHEMBL29568535	0.88	APLNR (0.49)	ITGB3ITGAVAPLNRNMBRGRPR
SCHEMBL29568928	0.88	APLNR (0.44)	ITGB3ITGAVAPLNRCALCRF2
SCHEMBL29802102	0.86	F2 (0.45)	F2C5AR1CTSLCTSSCTSK
SCHEMBL29569112	0.85	APLNR (0.43)	ITGB3ITGAVAPLNRCALCRF2
SCHEMBL30974624	0.85	F2 (0.51)	ITGB3ITGAVAPLNRCALCRHCRTR1
SCHEMBL29568907	0.85	ITGB3 (0.46)	ITGB3ITGAVAPLNRCALCRF2
SCHEMBL30933087	0.84	APLNR (0.56)	APLNRNMBRGRPRCALCRHCRTR1
SCHEMBL31232550	0.84	C5AR1 (0.53)	ITGB3ITGAVAPLNRCALCRC5AR1

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
EP-3320923-B1	FLUORESCENT IMAGING AGENTS	VISEN MEDICAL INC (US)	2022-04-06	—	—	EP	claimed