SCHEMBL30411733

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

nearest known ligand 0.54

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	GRB2	P62993	1/20	0.54

▸	XIAP	P98170	1/20	0.46

▸	ACE	P12821	1/20	0.46

▸	NTSR2	O95665	3/20	0.46

▸	NTSR1	P30989	3/20	0.46

▸	SORT1	Q99523	3/20	0.46

▸	ANPEP	P15144	1/20	0.46

▸	LNPEP	Q9UIQ6	1/20	0.46

▸	TGM2	P21980	1/20	0.43

▸	AGTR1	P30556	2/20	0.42

▸	OPRM1	P35372	1/20	0.42

▸	OPRD1	P41143	1/20	0.42

▸	OPRK1	P41145	1/20	0.42

▸	AGTR2	P50052	2/20	0.42

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
SCHEMBL30411890	0.85	NTSR2 (0.45)	XIAPNTSR2NTSR1SORT1
SCHEMBL31665888	0.85	NTSR2 (0.45)	XIAPNTSR2NTSR1SORT1
SCHEMBL30599190	0.84	GRB2 (0.54)	GRB2XIAPACENTSR2NTSR1
SCHEMBL31289506	0.83	ACE (0.47)	ACENTSR2NTSR1SORT1OPRK1
SCHEMBL31257010	0.83	XIAP (0.57)	GRB2XIAPNTSR2NTSR1SORT1
SCHEMBL30490558	0.82	ACE (0.50)	GRB2ACEOPRK1
SCHEMBL29777636	0.81	ACE (0.46)	GRB2ACENTSR2NTSR1
SCHEMBL30599189	0.80	XIAP (0.53)	GRB2XIAPACENTSR2NTSR1
SCHEMBL30052312	0.79	XIAP (0.56)	XIAPACE
SCHEMBL29390805	0.79	XIAP (0.57)	XIAPACEANPEPLNPEP

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-116102616-A	Ginkgo-derived alpha-glucosidase inhibitory peptide and rapid screening method thereof	中国林业科学研究院林产化学工业研究所	2023-05-12	—	—	CN	disclosed