SCHEMBL29960300

C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)[C@@H](C)O)[C@@H](C)O)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	10/20	0.52

▸	OPRM1	P35372	6/20	0.52

▸	BACE1	P56817	3/20	0.50

▸	BACE2	Q9Y5Z0	3/20	0.50

▸	OPRK1	P41145	1/20	0.48

▸	CASP3	P42574	1/20	0.48

▸	CASP7	P55210	1/20	0.48

▸	LTA4H	P09960	2/20	0.47

▸	CCKAR	P32238	1/20	0.46

▸	CCKBR	P32239	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
SCHEMBL38662319	0.96	OPRD1 (0.53)	OPRD1OPRM1BACE1BACE2OPRK1
SCHEMBL31366752	0.90	OPRM1 (0.55)	OPRD1OPRM1BACE1BACE2OPRK1
SCHEMBL29700033	0.89	NPY4R (0.54)	—
SCHEMBL31228813	0.89	OPRM1 (0.52)	OPRD1OPRM1BACE1BACE2OPRK1
SCHEMBL8575457	0.88	OPRD1 (0.59)	OPRD1OPRM1OPRK1LTA4H
SCHEMBL8575450	0.88	OPRD1 (0.59)	OPRD1OPRM1OPRK1LTA4H
SCHEMBL29402842	0.87	OPRD1 (0.64)	OPRD1OPRM1OPRK1
SCHEMBL31366730	0.87	OPRD1 (0.53)	OPRD1OPRM1OPRK1
SCHEMBL29702198	0.86	OPRM1 (0.52)	OPRD1OPRM1OPRK1
SCHEMBL31257978	0.86	OPRD1 (0.57)	OPRD1OPRM1OPRK1

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-109988770-B	Heavy chain and light chain variable region gene of c-di-AMP synthetase monoclonal antibody, encoded polypeptide and application thereof	中国人民解放军第四军医大学	2022-11-22	—	—	CN	disclosed