SCHEMBL10537009

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

nearest known ligand 0.61

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	MAGI3	Q5TCQ9	1/20	0.61

▸	GLP1R	P43220	8/20	0.60

▸	PCSK9	Q8NBP7	2/20	0.59

▸	TLR2	O60603	4/20	0.58

▸	RXFP1	Q9HBX9	1/20	0.57

▸	ECE1	P42892	1/20	0.57

▸	MUS81	Q96NY9	1/20	0.57

▸	IL23R	Q5VWK5	1/20	0.56

▸	NPBWR1	P48145	1/20	0.56

▸	PTH1R	Q03431	1/20	0.56

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
SCHEMBL30571154	0.91	GLP1R (0.61)	MAGI3GLP1RPCSK9TLR2RXFP1
SCHEMBL29679523	0.90	GLP1R (0.69)	GLP1RRXFP1ECE1MUS81PTH1R
SCHEMBL29609550	0.89	ERAP2 (0.60)	MAGI3TLR2IL23R
SCHEMBL38650746	0.89	GLP1R (0.65)	GLP1RECE1MUS81IL23RNPBWR1
SCHEMBL30130581	0.88	EDNRA (0.59)	MAGI3PCSK9TLR2NPBWR1
SCHEMBL29583388	0.88	GLP1R (0.61)	GLP1RPCSK9RXFP1ECE1MUS81
SCHEMBL31093453	0.88	RXFP1 (0.69)	GLP1RRXFP1ECE1MUS81PTH1R
SCHEMBL28081219	0.88	GLP1R (0.61)	GLP1RRXFP1ECE1MUS81NPBWR1
SCHEMBL31664370	0.88	RXFP1 (0.68)	GLP1RRXFP1ECE1MUS81PTH1R
SCHEMBL30874388	0.87	GLP1R (0.60)	MAGI3GLP1RRXFP1ECE1MUS81

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
WO-1989010416-A1	PROTECTIVE PEPTIDES DERIVED FROM HUMAN IMMUNODEFICIENCY VIRUS-1 gp160	TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US)	1989-11-02	—	—	WO	disclosed