SCHEMBL30473775

C[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CXCR4	P61073	1/20	0.43

▸	APLNR	P35414	1/20	0.43

▸	BDKRB2	P30411	1/20	0.42

▸	GLP1R	P43220	7/20	0.42

▸	GIPR	P48546	7/20	0.42

▸	OPRD1	P41143	2/20	0.42

▸	OPRM1	P35372	1/20	0.42

▸	GCGR	P47871	1/20	0.40

▸	CAPN1	P07384	2/20	0.40

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
SCHEMBL30473784	1.00	CXCR4 (0.43)	CXCR4APLNRBDKRB2GLP1RGIPR
SCHEMBL30473772	0.96	OPRM1 (0.46)	CXCR4APLNRBDKRB2GLP1RGIPR
SCHEMBL30473780	0.96	OPRM1 (0.46)	CXCR4APLNRBDKRB2GLP1RGIPR
SCHEMBL29358088	0.95	APLNR (0.46)	CXCR4APLNRBDKRB2GLP1RGIPR
SCHEMBL29669221	0.91	CXCR4 (0.49)	CXCR4APLNRGLP1RGIPROPRD1
SCHEMBL30914237	0.90	OPRM1 (0.47)	APLNRBDKRB2GLP1RGIPROPRD1
SCHEMBL31399254	0.89	OPRM1 (0.46)	CXCR4APLNRGLP1RGIPROPRD1
SCHEMBL31042468	0.88	OPRM1 (0.42)	CXCR4APLNRBDKRB2OPRD1OPRM1
SCHEMBL29554130	0.86	CAPN1 (0.47)	APLNRBDKRB2OPRD1OPRM1CAPN1
SCHEMBL30307615	0.86	OPRM1 (0.46)	CXCR4BDKRB2OPRD1OPRM1CAPN1

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-116390938-A	Exendin-4 analogues	TXP制药股份有限公司	2023-07-04	—	—	CN	disclosed