SCHEMBL29638291

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](N)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	LNPEP	Q9UIQ6	5/20	0.66

▸	ANPEP	P15144	3/20	0.66

▸	SLC6A2	P23975	1/20	0.59

▸	DPP3	Q9NY33	3/20	0.55

▸	REN	P00797	1/20	0.55

▸	CMA1	P23946	3/20	0.53

▸	AGTR1	P30556	2/20	0.53

▸	AGTR2	P50052	2/20	0.53

▸	ACE	P12821	1/20	0.52

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
SCHEMBL29638282	0.97	LNPEP (0.68)	LNPEPANPEPSLC6A2DPP3REN
SCHEMBL29638293	0.96	LNPEP (0.63)	LNPEPANPEPSLC6A2REN
SCHEMBL31121210	0.95	LNPEP (0.66)	LNPEPANPEPSLC6A2DPP3REN
SCHEMBL29392664	0.92	LNPEP (0.65)	LNPEPANPEPSLC6A2DPP3REN
SCHEMBL30434308	0.91	LNPEP (0.59)	LNPEPANPEPSLC6A2DPP3REN
SCHEMBL29638298	0.91	LNPEP (0.62)	LNPEPANPEPSLC6A2DPP3REN
SCHEMBL30695688	0.90	SLC6A2 (0.55)	LNPEPANPEPSLC6A2DPP3REN
SCHEMBL29638302	0.89	REN (0.62)	LNPEPANPEPSLC6A2REN
SCHEMBL29638288	0.87	DPP3 (0.58)	LNPEPANPEPSLC6A2DPP3REN
SCHEMBL30616201	0.87	DPP3 (0.58)	LNPEPANPEPSLC6A2DPP3REN

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-109400683-B	Antitumor cyclic peptide and preparation method and application thereof	安徽工程大学	2022-05-17	—	—	CN	disclosed