SCHEMBL31362700

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

nearest known ligand 0.52

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR2	O95665	10/20	0.51

▸	NTSR1	P30989	10/20	0.51

▸	SORT1	Q99523	9/20	0.51

▸	OPRD1	P41143	4/20	0.47

▸	CALCRL	Q16602	2/20	0.47

▸	NMUR2	Q9GZQ4	1/20	0.47

▸	NMUR1	Q9HB89	1/20	0.47

▸	OPRM1	P35372	1/20	0.47

▸	MAPK8	P45983	1/20	0.47

▸	MAPK9	P45984	1/20	0.47

▸	MAPK10	P53779	1/20	0.47

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
SCHEMBL29727282	0.95	NTSR2 (0.52)	NTSR2NTSR1SORT1OPRD1CALCRL
SCHEMBL31362672	0.92	NMUR2 (0.50)	OPRD1CALCRLNMUR2NMUR1OPRM1
SCHEMBL31362692	0.90	ACE (0.49)	OPRD1OPRM1
SCHEMBL31362702	0.88	MAPK8 (0.51)	NTSR2NTSR1SORT1OPRD1CALCRL
SCHEMBL38660201	0.86	AGTR1 (0.50)	NTSR2NTSR1SORT1OPRD1NMUR2
SCHEMBL28594198	0.86	NTSR2 (0.50)	NTSR2NTSR1SORT1OPRD1CALCRL
SCHEMBL30459251	0.86	REN (0.53)	NTSR2NTSR1SORT1OPRD1MAPK8
SCHEMBL31191392	0.85	OPRD1 (0.52)	NTSR2NTSR1SORT1OPRD1NMUR2
SCHEMBL29531760	0.84	CALCRL (0.53)	OPRD1CALCRLOPRM1
SCHEMBL31553198	0.84	ACE (0.52)	OPRD1CALCRLOPRM1

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-119390815-A	Whey protein peptide, whey protein fermentation concentrate, and preparation method and application thereof	张少辉	2025-02-07	—	—	CN	disclosed