SCHEMBL30353263

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

nearest known ligand 0.58

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	SLC6A2	P23975	2/20	0.58

▸	CALCRL	Q16602	5/20	0.57

▸	DPP3	Q9NY33	2/20	0.52

▸	REN	P00797	1/20	0.52

▸	ELANE	P08246	1/20	0.51

▸	XIAP	P98170	2/20	0.51

▸	LNPEP	Q9UIQ6	2/20	0.50

▸	CMA1	P23946	1/20	0.50

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
SCHEMBL30558307	0.90	SLC6A2 (0.61)	SLC6A2CALCRLDPP3RENELANE
SCHEMBL31596917	0.88	SLC6A2 (0.71)	SLC6A2CALCRL
SCHEMBL31124672	0.88	SLC6A2 (0.60)	SLC6A2CALCRLDPP3RENLNPEP
SCHEMBL29575950	0.88	SLC6A2 (0.55)	SLC6A2CALCRLDPP3RENLNPEP
SCHEMBL31226681	0.87	LNPEP (0.55)	SLC6A2CALCRLRENLNPEPCMA1
SCHEMBL30558304	0.87	SLC6A2 (0.75)	SLC6A2CALCRLRENCMA1
SCHEMBL31257046	0.86	SLC6A2 (0.57)	SLC6A2CALCRLREN
SCHEMBL29602423	0.85	SLC6A2 (0.62)	SLC6A2CALCRLDPP3RENLNPEP
SCHEMBL29866553	0.85	XIAP (0.52)	SLC6A2CALCRLELANEXIAP
SCHEMBL29695544	0.84	CALCRL (0.58)	SLC6A2CALCRLDPP3RENLNPEP

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-113912675-B	Centipede polypeptide with analgesic activity and application thereof	中国药科大学	2023-04-11	—	—	CN	disclosed