SCHEMBL30495505

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

nearest known ligand 0.54

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	OPRM1	P35372	4/20	0.54

▸	OPRD1	P41143	4/20	0.54

▸	BDKRB2	P30411	4/20	0.51

▸	SLC6A2	P23975	1/20	0.48

▸	ACE	P12821	1/20	0.48

▸	REN	P00797	1/20	0.48

▸	CALCRL	Q16602	2/20	0.48

▸	EPHA2	P29317	2/20	0.47

▸	AKT1	P31749	1/20	0.46

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
SCHEMBL29856163	0.84	SLC6A2 (0.58)	OPRM1OPRD1SLC6A2ACEREN
SCHEMBL31182919	0.83	KEAP1 (0.54)	CALCRL
SCHEMBL29512206	0.82	CALCRL (0.49)	OPRM1OPRD1ACECALCRL
SCHEMBL30475332	0.82	OPRM1 (0.59)	OPRM1OPRD1BDKRB2SLC6A2REN
SCHEMBL31390815	0.82	SLC6A2 (0.56)	OPRM1OPRD1SLC6A2RENCALCRL
SCHEMBL11284539	0.81	OPRM1 (0.52)	OPRM1OPRD1EPHA2AKT1
SCHEMBL11284534	0.81	OPRM1 (0.52)	OPRM1OPRD1EPHA2AKT1
SCHEMBL29695544	0.81	CALCRL (0.58)	SLC6A2ACERENCALCRL
SCHEMBL30311985	0.81	KEAP1 (0.49)	OPRD1SLC6A2RENCALCRL
SCHEMBL30311937	0.81	CMA1 (0.51)	OPRM1OPRD1SLC6A2REN

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-111378638-B	Helicobacter pylori phage lyase and preparation method thereof	江苏万邦医药科技有限公司	2023-05-05	—	—	CN	disclosed