SCHEMBL8429835

C[C@H](N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	NMUR2	Q9GZQ4	1/20	0.54

▸	CXCL8	P10145	5/20	0.52

▸	CCKBR	P32239	2/20	0.51

▸	OPRM1	P35372	1/20	0.51

▸	OPRD1	P41143	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
SCHEMBL8429429	0.87	CXCL8 (0.46)	NMUR2CXCL8
SCHEMBL8427600	0.86	BDKRB2 (0.43)	NMUR2CXCL8OPRM1OPRD1
SCHEMBL8431318	0.84	CXCL8 (0.45)	CXCL8
SCHEMBL8429833	0.83	CXCL8 (0.46)	CXCL8
SCHEMBL30186405	0.82	OPRD1 (0.59)	OPRM1OPRD1
SCHEMBL30444466	0.81	NMUR2 (0.59)	NMUR2
SCHEMBL29848357	0.80	SLC6A2 (0.51)	NMUR2CXCL8OPRM1
SCHEMBL31483575	0.80	SLC6A2 (0.58)	OPRM1OPRD1
SCHEMBL6519107	0.80	OPRD1 (0.57)	NMUR2OPRM1OPRD1
SCHEMBL31491082	0.80	NMUR2 (0.54)	NMUR2CXCL8OPRM1OPRD1

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
US-5859187-A	Antiviral peptides	E. R. SQUIBB & SONS, INC. (US)	1999-01-12	—	—	US	disclosed