SCHEMBL30475332

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

nearest known ligand 0.59

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	OPRM1	P35372	6/20	0.59

▸	OPRD1	P41143	5/20	0.59

▸	SLC6A2	P23975	1/20	0.55

▸	REN	P00797	2/20	0.54

▸	OPRK1	P41145	1/20	0.53

▸	BDKRB2	P30411	1/20	0.53

▸	F2	P00734	1/20	0.51

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
SCHEMBL30542249	0.85	OPRM1 (0.56)	OPRM1OPRD1OPRK1BDKRB2F2
SCHEMBL31741269	0.85	LNPEP (0.53)	OPRM1OPRD1RENBDKRB2
SCHEMBL31289577	0.85	SLC6A2 (0.64)	OPRM1OPRD1SLC6A2OPRK1
SCHEMBL31718134	0.85	SLC6A2 (0.64)	OPRM1OPRD1SLC6A2OPRK1
SCHEMBL30833609	0.82	OPRM1 (0.70)	OPRM1OPRD1SLC6A2OPRK1F2
SCHEMBL29592291	0.82	BDKRB2 (0.58)	OPRM1OPRD1OPRK1BDKRB2
SCHEMBL30576724	0.82	OPRM1 (0.62)	OPRM1OPRD1OPRK1
SCHEMBL31412199	0.82	OPRM1 (0.66)	OPRM1OPRD1SLC6A2OPRK1
SCHEMBL30833622	0.82	OPRM1 (0.66)	OPRM1OPRD1SLC6A2OPRK1
SCHEMBL29702054	0.82	OPRM1 (0.66)	OPRM1OPRD1SLC6A2OPRK1

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-115974971-A	Four angiotensin transferase inhibitors derived from millet protein and application thereof	中国农业大学	2023-04-18	—	—	CN	disclosed