SCHEMBL16063027

CC[C@H](C)[C@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C

nearest known ligand 0.55

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	GLP1R	P43220	7/20	0.55

▸	EDNRA	P25101	1/20	0.55

▸	NPBWR1	P48145	2/20	0.55

▸	ERAP2	Q6P179	1/20	0.54

▸	BACE1	P56817	2/20	0.54

▸	ECE1	P42892	1/20	0.53

▸	MUS81	Q96NY9	1/20	0.53

▸	RXFP1	Q9HBX9	1/20	0.53

▸	CTSB	P07858	1/20	0.52

▸	CTSK	P43235	1/20	0.52

▸	GHSR	Q92847	1/20	0.52

▸	PTH1R	Q03431	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
SCHEMBL30874388	0.96	GLP1R (0.60)	GLP1RNPBWR1BACE1ECE1MUS81
SCHEMBL29706172	0.94	NPBWR1 (0.56)	GLP1REDNRANPBWR1CTSBCTSK
SCHEMBL29634678	0.94	GLP1R (0.59)	GLP1RNPBWR1BACE1ECE1MUS81
SCHEMBL30874380	0.92	EDNRA (0.58)	EDNRAERAP2BACE1CTSBCTSK
SCHEMBL30874405	0.92	RXFP1 (0.64)	GLP1RECE1MUS81RXFP1PTH1R
SCHEMBL30721568	0.92	EDNRA (0.60)	EDNRANPBWR1ERAP2BACE1
SCHEMBL29634675	0.91	GLP1R (0.63)	GLP1RNPBWR1ECE1MUS81RXFP1
SCHEMBL31099263	0.91	GLP1R (0.63)	GLP1RNPBWR1ECE1MUS81RXFP1
SCHEMBL30977971	0.91	NPBWR1 (0.59)	EDNRANPBWR1GHSR
SCHEMBL30576557	0.91	EDNRA (0.61)	EDNRANPBWR1ERAP2CTSBCTSK

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-8835381-B2	Methods for detecting protein in plasma	GLAXOSMITHKLINE LLC (US)	2014-09-16	—	—	US	disclosed