SCHEMBL8836985

CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	OPRM1	P35372	11/20	0.60

▸	OPRK1	P41145	11/20	0.60

▸	F2	P00734	1/20	0.57

▸	NTSR2	O95665	2/20	0.55

▸	NTSR1	P30989	2/20	0.55

▸	SORT1	Q99523	2/20	0.55

▸	OPRD1	P41143	2/20	0.55

▸	KDM1A	O60341	1/20	0.55

▸	REN	P00797	1/20	0.53

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
SCHEMBL31219332	0.93	REN (0.54)	OPRM1OPRK1F2NTSR2NTSR1
SCHEMBL8837010	0.93	OPRM1 (0.59)	OPRM1OPRK1NTSR2NTSR1SORT1
SCHEMBL30458665	0.91	OPRM1 (0.58)	OPRM1OPRK1F2NTSR2NTSR1
SCHEMBL29366560	0.89	NMUR2 (0.59)	OPRM1OPRK1NTSR1OPRD1REN
SCHEMBL30053247	0.89	KDM1A (0.62)	NTSR2NTSR1SORT1KDM1A
SCHEMBL31634123	0.89	NTSR2 (0.60)	OPRM1OPRK1NTSR2NTSR1SORT1
SCHEMBL30455728	0.87	NTSR2 (0.58)	OPRM1OPRK1NTSR2NTSR1SORT1
SCHEMBL30578077	0.87	NTSR2 (0.58)	OPRM1OPRK1F2NTSR2NTSR1
SCHEMBL29602023	0.87	NTSR2 (0.58)	OPRM1OPRK1F2NTSR2NTSR1
SCHEMBL29568528	0.87	RAMP3 (0.50)	OPRM1OPRK1NTSR2NTSR1SORT1

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-5593832-A	IDENTIFICATION BASED ON ANALYSIS OF DNA LENGTH POLYMORPHISMS GENERATED BY THE ACTION OF RESTRICTION ENDONUCLEASES	LIFECODES CORPORATION (US)	1997-01-14	—	—	US	disclosed