Phenylalanine

SCHEMBL9543648

C[C@H](N)C(=O)O.NC(=O)[C@@H](N)Cc1ccc(O)cc1.N[C@@H](Cc1ccccc1)C(=O)O.O=C(N[C@@H](Cc1ccccc1)C(=O)O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	ITGB3	P05106	8/20	0.53

▸	ITGA2B	P08514	8/20	0.53

▸	CTSL	P07711	5/20	0.52

▸	CTSB	P07858	4/20	0.52

▸	CTSS	P25774	2/20	0.52

▸	CTSK	P43235	2/20	0.52

▸	ECE1	P42892	2/20	0.52

▸	MME	P08473	1/20	0.52

▸	ALDH1A1	P00352	1/20	0.51

▸	ALOX15	P16050	1/20	0.51

▸	SLC7A5	Q01650	1/20	0.49

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
SCHEMBL8187477	0.94	ITGB3 (0.59)	ITGB3ITGA2BCTSLCTSBCTSS
Phenylalanine Amide SCHEMBL8187861	0.89	ITGB3 (0.60)	ITGB3ITGA2BCTSLCTSBCTSS
D-Phenylalanine SCHEMBL9445679	0.87	ITGB3 (0.63)	ITGB3ITGA2BCTSLCTSBCTSS
Valine SCHEMBL5482608	0.86	ITGB3 (0.56)	ITGB3ITGA2BCTSLCTSBCTSS
Phenylalanine SCHEMBL7317243	0.85	ALDH1A1 (0.59)	ITGB3ITGA2BCTSLCTSBCTSS
SCHEMBL221300	0.84	ECE1 (0.65)	ITGB3ITGA2BCTSLCTSBCTSS
Phenylalanine SCHEMBL9539848	0.84	SLC7A5 (0.69)	ALOX15SLC7A5
SCHEMBL1702159	0.84	ECE1 (0.65)	ITGB3ITGA2BCTSLCTSBCTSS
SCHEMBL10507966	0.84	ECE1 (0.65)	ITGB3ITGA2BCTSLCTSBCTSS
SCHEMBL6118298	0.84	ECE1 (0.65)	ITGB3ITGA2BCTSLCTSBCTSS

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-1993000427-A2	NEURITE GROWTH REGULATORY FACTORS	ERZIEHUNGSDIREKTION OF THE CANTON ZURICH (CH)	1993-01-07	—	—	WO	claimed