SCHEMBL11047360

C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(N)=O

nearest known ligand 0.58

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	OPRM1	P35372	2/20	0.57

▸	OPRD1	P41143	2/20	0.57

▸	OPRK1	P41145	2/20	0.57

▸	KISS1R	Q969F8	3/20	0.56

▸	GHSR	Q92847	1/20	0.52

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
SCHEMBL11042205	0.94	OPRK1 (0.53)	OPRK1GHSR
SCHEMBL11045742	0.94	OPRK1 (0.53)	OPRK1GHSR
SCHEMBL11044131	0.94	OPRK1 (0.53)	OPRK1GHSR
SCHEMBL11043731	0.94	OPRK1 (0.53)	OPRK1GHSR
SCHEMBL31243852	0.90	OPRD1 (0.54)	OPRM1OPRD1OPRK1KISS1R
SCHEMBL31243868	0.90	OPRD1 (0.54)	OPRM1OPRD1OPRK1KISS1R
SCHEMBL31243891	0.90	OPRD1 (0.54)	OPRM1OPRD1OPRK1KISS1R
SCHEMBL31243882	0.90	KISS1R (0.54)	OPRM1OPRD1OPRK1KISS1R
SCHEMBL11045505	0.90	OPRK1 (0.50)	OPRK1GHSR
SCHEMBL11045721	0.90	OPRK1 (0.50)	OPRK1GHSR

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-4455303-A	Renin inhibitors	THE GENERAL HOSPITAL CORPORATION (US)	1984-06-19	—	—	US	disclosed