SCHEMBL29884130

C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	OPRM1	P35372	5/20	0.61

▸	OPRD1	P41143	5/20	0.61

▸	SLC6A2	P23975	1/20	0.54

▸	RAMP3	O60896	1/20	0.51

▸	CALCR	P30988	1/20	0.51

▸	NMUR2	Q9GZQ4	2/20	0.51

▸	NMUR1	Q9HB89	2/20	0.51

▸	BDKRB2	P30411	1/20	0.51

▸	NTSR1	P30989	1/20	0.50

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
SCHEMBL30625026	0.92	OPRM1 (0.64)	OPRM1OPRD1SLC6A2RAMP3CALCR
SCHEMBL29376302	0.92	OPRM1 (0.64)	OPRM1OPRD1SLC6A2RAMP3CALCR
SCHEMBL29581123	0.88	OPRM1 (0.56)	OPRM1OPRD1SLC6A2RAMP3CALCR
SCHEMBL29993441	0.88	OPRM1 (0.59)	OPRM1OPRD1
SCHEMBL29705074	0.87	SLC6A2 (0.59)	OPRM1OPRD1SLC6A2NTSR1
SCHEMBL30622604	0.87	NTSR1 (0.59)	SLC6A2NTSR1
SCHEMBL31694459	0.87	OPRM1 (0.61)	OPRM1OPRD1NMUR2NMUR1BDKRB2
SCHEMBL30495770	0.86	OPRM1 (0.60)	OPRM1OPRD1SLC6A2RAMP3CALCR
SCHEMBL30832768	0.86	BDKRB2 (0.49)	OPRM1OPRD1SLC6A2RAMP3CALCR
SCHEMBL29702226	0.86	SLC6A2 (0.62)	OPRM1OPRD1SLC6A2

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-113321743-B	Chimeric antigen receptor of targeting lysyl oxidase 1 and application thereof	海南精准医疗科技有限公司	2022-10-21	—	—	CN	disclosed