SCHEMBL31073544

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 16)

	gene	UniProt	supporting neighbours	confidence
▸	KISS1R	Q969F8	5/20	0.57

▸	GLP1R	P43220	4/20	0.56

▸	CCKBR	P32239	2/20	0.56

▸	F2	P00734	4/20	0.55

▸	GCGR	P47871	1/20	0.54

▸	GIPR	P48546	1/20	0.54

▸	KEAP1	Q14145	1/20	0.54

▸	NPY1R	P25929	1/20	0.53

▸	NPY2R	P49146	1/20	0.53

▸	NPY4R	P50391	1/20	0.53

▸	NPY5R	Q15761	1/20	0.53

▸	REN	P00797	1/20	0.52

▸	C5AR1	P21730	1/20	0.52

▸	NMBR	P28336	1/20	0.52

▸	GRPR	P30550	1/20	0.52

▸	CXCL8	P10145	1/20	0.51

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
SCHEMBL31182843	0.89	F2 (0.62)	KISS1RGLP1RCCKBRF2NPY1R
SCHEMBL29450228	0.87	F2 (0.60)	GLP1RCCKBRF2NPY1RNPY2R
SCHEMBL30883220	0.87	CXCR4 (0.64)	GLP1RCCKBRF2GCGRNPY1R
SCHEMBL30767712	0.86	F2 (0.58)	GLP1RCCKBRF2GCGRGIPR
SCHEMBL30834802	0.86	CAPN1 (0.58)	KISS1RGLP1RCCKBRF2GCGR
SCHEMBL29530804	0.86	GLP1R (0.65)	GLP1RCCKBRGCGRGIPRKEAP1
SCHEMBL30997485	0.86	CTSL (0.53)	KISS1RGLP1RGCGRGIPRKEAP1
SCHEMBL29827329	0.86	F2 (0.62)	GLP1RCCKBRF2KEAP1REN
SCHEMBL30504132	0.85	F2 (0.62)	KISS1RGLP1RCCKBRF2NPY1R
SCHEMBL30906445	0.85	GLP1R (0.63)	GLP1RCCKBRF2GCGR

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-118777592-A	Colloidal gold test strip for detecting anti-PLA 2R antibody, preparation method thereof, kit and application	江南大学	2024-10-15	—	—	CN	disclosed