SCHEMBL30690366

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

nearest known ligand 0.55

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	GRPR	P30550	4/20	0.55

▸	RXFP1	Q9HBX9	2/20	0.54

▸	GLP1R	P43220	6/20	0.53

▸	PCSK9	Q8NBP7	1/20	0.51

▸	EDNRA	P25101	1/20	0.50

▸	NPBWR1	P48145	4/20	0.49

▸	MAGI3	Q5TCQ9	1/20	0.49

▸	PRMT1	Q99873	1/20	0.49

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
SCHEMBL29443913	0.98	RXFP1 (0.54)	GRPRRXFP1GLP1RPCSK9EDNRA
SCHEMBL30690371	0.97	PCSK9 (0.54)	GRPRRXFP1GLP1RPCSK9EDNRA
SCHEMBL30690374	0.96	GLP1R (0.54)	GRPRRXFP1GLP1RPCSK9EDNRA
SCHEMBL30690361	0.96	GLP1R (0.54)	GRPRRXFP1GLP1RPCSK9EDNRA
SCHEMBL30690354	0.87	RXFP1 (0.63)	GRPRRXFP1GLP1R
SCHEMBL29443915	0.87	GLP1R (0.64)	RXFP1GLP1RMAGI3
SCHEMBL29742991	0.85	EDNRA (0.54)	GRPRRXFP1GLP1RPCSK9EDNRA
SCHEMBL31536185	0.85	PRMT1 (0.55)	GRPRPCSK9EDNRANPBWR1PRMT1
SCHEMBL30455706	0.85	GRPR (0.51)	GRPRNPBWR1
SCHEMBL29443919	0.85	OPRM1 (0.63)	GLP1RNPBWR1

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
CN-110041432-B	chimeric antigen receptor	细胞基因公司	2023-12-05	—	—	CN	disclosed