SCHEMBL29638290

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

nearest known ligand 0.56

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	LNPEP	Q9UIQ6	2/20	0.56

▸	ANPEP	P15144	1/20	0.56

▸	DPP3	Q9NY33	2/20	0.56

▸	SLC6A2	P23975	1/20	0.54

▸	REN	P00797	3/20	0.53

▸	ACE	P12821	1/20	0.52

▸	OPRM1	P35372	1/20	0.50

▸	OPRD1	P41143	1/20	0.50

▸	OPRK1	P41145	1/20	0.50

▸	PSMB9	P28065	1/20	0.49

▸	XIAP	P98170	1/20	0.49

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
SCHEMBL29638288	0.97	DPP3 (0.58)	LNPEPANPEPDPP3SLC6A2REN
SCHEMBL30616201	0.94	DPP3 (0.58)	LNPEPANPEPDPP3SLC6A2REN
SCHEMBL30945872	0.92	DPP3 (0.62)	LNPEPANPEPDPP3SLC6A2REN
SCHEMBL29638285	0.91	LNPEP (0.62)	LNPEPANPEPREN
SCHEMBL29638293	0.88	LNPEP (0.63)	LNPEPANPEPSLC6A2REN
SCHEMBL29638282	0.88	LNPEP (0.68)	LNPEPANPEPDPP3SLC6A2REN
SCHEMBL29638299	0.88	LNPEP (0.63)	LNPEPANPEPDPP3SLC6A2REN
SCHEMBL29638302	0.88	REN (0.62)	LNPEPANPEPSLC6A2REN
SCHEMBL31016729	0.87	SLC6A2 (0.59)	DPP3SLC6A2RENACEOPRM1
SCHEMBL29664214	0.85	DPP3 (0.57)	LNPEPANPEPDPP3SLC6A2ACE

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