SCHEMBL29802631

C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	SLC6A2	P23975	1/20	0.60

▸	OPRM1	P35372	2/20	0.55

▸	OPRD1	P41143	1/20	0.55

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
SCHEMBL31452908	0.94	SLC6A2 (0.57)	SLC6A2OPRM1OPRD1
SCHEMBL31276072	0.90	SLC6A2 (0.69)	SLC6A2
SCHEMBL31583875	0.89	NMUR2 (0.54)	SLC6A2
SCHEMBL30692437	0.89	REN (0.51)	SLC6A2
SCHEMBL29448041	0.88	SLC6A2 (0.65)	SLC6A2OPRM1OPRD1
SCHEMBL30504145	0.87	F2 (0.67)	SLC6A2OPRM1OPRD1
SCHEMBL31090172	0.87	SLC6A2 (0.64)	SLC6A2OPRM1OPRD1
SCHEMBL30495776	0.87	F2 (0.59)	SLC6A2OPRM1OPRD1
SCHEMBL32665679	0.86	SLC6A2 (0.51)	SLC6A2OPRM1OPRD1
SCHEMBL29701255	0.86	SLC6A2 (0.63)	SLC6A2OPRM1

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-2022190064-A1	METHODS FOR IDENTIFYING SUBJECTS WITH BETACORONAVIRUS INFECTIONS WHO ARE AT RISK OF ACUTE RESPIRATORY SYNDROME AND METHODS FOR THE TREATMENT OF SAME	VEXO PHARMACEUTICALS DMCC (AE)	2022-09-15	—	—	WO	disclosed