SCHEMBL29823435

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 17)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	8/20	0.55

▸	NPY4R	P50391	8/20	0.55

▸	NPY5R	Q15761	8/20	0.55

▸	NPY1R	P25929	6/20	0.55

▸	CALCR	P30988	4/20	0.54

▸	C5AR1	P21730	1/20	0.52

▸	KEAP1	Q14145	1/20	0.52

▸	MAPK8	P45983	1/20	0.51

▸	MAPK9	P45984	1/20	0.51

▸	MAPK10	P53779	1/20	0.51

▸	CTSL	P07711	2/20	0.51

▸	CTSS	P25774	2/20	0.51

▸	CTSK	P43235	2/20	0.51

▸	CTSH	P09668	1/20	0.51

▸	F2	P00734	1/20	0.51

▸	EP300	Q09472	1/20	0.51

▸	HIF1A	Q16665	1/20	0.51

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
SCHEMBL30512628	0.89	F2 (0.56)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29743008	0.85	CTSL (0.56)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL29742982	0.85	CALCR (0.65)	CALCRKEAP1F2
SCHEMBL30576952	0.85	C5AR1 (0.56)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL38661696	0.85	APLNR (0.57)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30487946	0.84	CALCR (0.61)	NPY1RCALCRC5AR1F2
SCHEMBL30930534	0.84	F2 (0.60)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30883275	0.84	CALCR (0.62)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30006301	0.83	F2 (0.50)	NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL11023111	0.83	AGTR1 (0.61)	C5AR1F2

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-114957392-B	Development and preparation method and application of Morchella esculenta flavor peptide base material	云南农业大学	2024-07-19	—	—	CN	disclosed
CN-114957392-A	Development and preparation method and application of morchella flavor-developing peptide flavor base material	云南农业大学	2022-08-30	—	—	CN	disclosed