SCHEMBL30437221

CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	6/20	0.70

▸	NPY4R	P50391	6/20	0.70

▸	NPY5R	Q15761	6/20	0.70

▸	NPY1R	P25929	4/20	0.70

▸	GCGR	P47871	3/20	0.64

▸	GIPR	P48546	3/20	0.64

▸	GLP1R	P43220	9/20	0.64

▸	CXCR4	P61073	1/20	0.63

▸	CALCA	P06881	1/20	0.62

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
SCHEMBL30495825	0.90	NPY2R (0.73)	NPY2RNPY4RNPY5RNPY1RGCGR
SCHEMBL30495629	0.90	NPY1R (0.69)	NPY2RNPY4RNPY5RNPY1RGCGR
SCHEMBL31182815	0.89	NPY2R (0.73)	NPY2RNPY4RNPY5RNPY1RGCGR
Cecropin Ad SCHEMBL29842479	0.89	NPY1R (0.68)	NPY2RNPY4RNPY5RNPY1RGCGR
SCHEMBL30658219	0.89	NPY2R (0.71)	NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL31182720	0.89	NPY2R (0.69)	NPY2RNPY4RNPY5RNPY1RGCGR
SCHEMBL31182745	0.89	NPY1R (0.71)	NPY2RNPY4RNPY5RNPY1RGCGR
SCHEMBL30536327	0.89	NPY2R (0.72)	NPY2RNPY4RNPY5RNPY1RGCGR
SCHEMBL29949636	0.89	NPY1R (0.71)	NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30536317	0.89	CXCR4 (0.67)	NPY2RNPY4RNPY5RNPY1RGCGR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-116103323-B	Polygonum multiflorum phenylalanine ammonia lyase gene FmPAL, and encoding product and application thereof	安徽中医药大学	2024-10-22	—	—	CN	disclosed
CN-116103323-A	Polygonum multiflorum phenylalanine ammonia lyase gene FmPAL, and encoding product and application thereof	安徽中医药大学	2023-05-12	—	—	CN	disclosed