SCHEMBL30486007

CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCSC)C(C)C)C(C)C)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	NTSR1	P30989	12/20	0.59

▸	NTSR2	O95665	10/20	0.59

▸	SORT1	Q99523	9/20	0.59

▸	AGTR1	P30556	2/20	0.55

▸	AGTR2	P50052	2/20	0.55

▸	CALCR	P30988	3/20	0.54

▸	OPRM1	P35372	1/20	0.53

▸	OPRD1	P41143	1/20	0.53

▸	OPRK1	P41145	1/20	0.53

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
SCHEMBL30486008	0.95	NPY1R (0.56)	NTSR1NTSR2SORT1AGTR1AGTR2
SCHEMBL31362658	0.86	AGTR1 (0.55)	NTSR1NTSR2SORT1AGTR1AGTR2
SCHEMBL30432493	0.85	CALCR (0.60)	NTSR1NTSR2CALCR
SCHEMBL31182965	0.85	CALCR (0.66)	NTSR1NTSR2SORT1CALCROPRM1
SCHEMBL30567696	0.84	CALCR (0.58)	NTSR1NTSR2SORT1CALCR
SCHEMBL31307276	0.84	NTSR1 (0.60)	NTSR1NTSR2SORT1OPRM1OPRD1
SCHEMBL31362693	0.84	OPRM1 (0.55)	NTSR1NTSR2SORT1OPRM1OPRD1
SCHEMBL29796613	0.83	NTSR1 (0.60)	NTSR1NTSR2SORT1AGTR1AGTR2
SCHEMBL29796500	0.83	NTSR1 (0.60)	NTSR1NTSR2SORT1AGTR1AGTR2
SCHEMBL29517484	0.83	NTSR1 (0.60)	NTSR1NTSR2SORT1AGTR1AGTR2

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-116462750-A	Bionic polypeptide based on protein FGF19 and application thereof	中国药科大学	2023-07-21	—	—	CN	disclosed