SCHEMBL29500420

C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)O)[C@@H](C)O

nearest known ligand 0.68

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	IL23R	Q5VWK5	6/20	0.68

▸	CXCR4	P61073	3/20	0.62

▸	GLP1R	P43220	8/20	0.61

▸	GIPR	P48546	6/20	0.61

▸	C5AR1	P21730	1/20	0.60

▸	NPY1R	P25929	1/20	0.59

▸	NPY2R	P49146	1/20	0.59

▸	NPY4R	P50391	1/20	0.59

▸	NPY5R	Q15761	1/20	0.59

▸	GCGR	P47871	2/20	0.59

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
SCHEMBL30658375	0.90	GLP1R (0.68)	CXCR4GLP1RGIPRNPY1RNPY2R
SCHEMBL29531957	0.89	IL23R (0.66)	IL23RCXCR4GLP1RGIPRC5AR1
SCHEMBL29713985	0.89	IL23R (0.68)	IL23RCXCR4GLP1RGIPRC5AR1
SCHEMBL31593275	0.88	C5AR1 (0.67)	IL23RCXCR4GLP1RGIPRC5AR1
SCHEMBL31593262	0.88	CXCR4 (0.62)	IL23RCXCR4GLP1RGIPRC5AR1
SCHEMBL30001569	0.88	IL23R (0.71)	IL23RCXCR4
SCHEMBL29430215	0.87	IL23R (0.69)	IL23RCXCR4GLP1RNPY1RNPY2R
SCHEMBL29672871	0.87	IL23R (0.70)	IL23RCXCR4GLP1RGIPRC5AR1
SCHEMBL30388109	0.86	IL23R (0.65)	IL23RCXCR4GLP1RGIPRC5AR1
SCHEMBL31105456	0.86	NPY2R (0.71)	IL23RCXCR4GLP1RC5AR1NPY1R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-113402595-B	Antioxidant polypeptide derived from tachypleus tridentatus antimicrobial peptide, and preparation and application thereof	上海海洋大学	2022-04-12	—	—	CN	claimed
CN-113402595-B	Antioxidant polypeptide derived from tachypleus tridentatus antimicrobial peptide, and preparation and application thereof	上海海洋大学	2022-04-12	—	—	CN	disclosed