SCHEMBL30873784

C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	17/20	0.51

▸	OPRM1	P35372	8/20	0.51

▸	OPRK1	P41145	2/20	0.51

▸	CCKBR	P32239	7/20	0.51

▸	CCKAR	P32238	6/20	0.51

▸	PTPN1	P18031	1/20	0.46

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
SCHEMBL30873785	0.96	OPRD1 (0.50)	OPRD1OPRM1OPRK1CCKBRCCKAR
SCHEMBL29802142	0.92	OPRD1 (0.47)	OPRD1OPRM1OPRK1CCKBRCCKAR
SCHEMBL31512990	0.90	BACE1 (0.51)	OPRD1CCKBRCCKAR
SCHEMBL30385928	0.89	F2 (0.47)	OPRD1OPRM1OPRK1CCKBRCCKAR
SCHEMBL30974069	0.88	OPRD1 (0.51)	OPRD1CCKBRCCKAR
SCHEMBL30974011	0.88	OPRD1 (0.49)	OPRD1OPRM1OPRK1CCKBRCCKAR
SCHEMBL30659883	0.88	OPRD1 (0.47)	OPRD1OPRM1OPRK1CCKBRCCKAR
SCHEMBL30659892	0.88	BACE1 (0.53)	PTPN1
SCHEMBL30823995	0.88	BACE1 (0.53)	PTPN1
SCHEMBL31442273	0.87	GLP1R (0.51)	—

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
CN-117924413-A	Maotai-flavor round base wine polypeptide and application thereof in influencing flavor of wine body	邵阳学院	2024-04-26	—	—	CN	claimed