SCHEMBL9181890

CC(C)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)[O-].CC(C)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)[O-].CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CN)C(=O)[Cu+2]

nearest known ligand 0.50

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	C5AR1	P21730	2/20	0.50

▸	OPRK1	P41145	2/20	0.47

▸	OPRD1	P41143	5/20	0.47

▸	F2	P00734	1/20	0.47

▸	REN	P00797	3/20	0.45

▸	APLNR	P35414	1/20	0.45

▸	SLC6A2	P23975	1/20	0.44

▸	OPRM1	P35372	2/20	0.44

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
SCHEMBL8953840	0.92	C5AR1 (0.52)	C5AR1OPRD1F2RENAPLNR
SCHEMBL8953791	0.92	C5AR1 (0.52)	C5AR1F2RENAPLNR
SCHEMBL8953877	0.88	C5AR1 (0.55)	C5AR1F2RENAPLNR
SCHEMBL10622567	0.87	C5AR1 (0.54)	C5AR1F2RENAPLNR
SCHEMBL5969907	0.84	F2 (0.52)	C5AR1OPRK1F2RENAPLNR
SCHEMBL30002373	0.83	ACE (0.53)	C5AR1OPRK1F2APLNROPRM1
SCHEMBL5969903	0.82	ACE (0.53)	C5AR1OPRK1F2APLNROPRM1
SCHEMBL2815390	0.82	F2 (0.49)	C5AR1OPRK1F2RENAPLNR
SCHEMBL9614994	0.81	GHSR (0.41)	C5AR1OPRK1F2OPRM1
SCHEMBL32691458	0.80	SLC6A2 (0.61)	C5AR1OPRD1F2RENSLC6A2

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
EP-0489860-B1	METHODS AND COMPOSITIONS FOR HEALING ULCERS	PROCYTE CORP (US)	1995-08-02	—	—	EP	disclosed