SCHEMBL30415232

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.67

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	C5AR1	P21730	2/20	0.67

▸	CXCR4	P61073	8/20	0.62

▸	NPY1R	P25929	1/20	0.59

▸	NPY2R	P49146	1/20	0.59

▸	NPY4R	P50391	1/20	0.59

▸	NPY5R	Q15761	1/20	0.59

▸	GLP1R	P43220	4/20	0.58

▸	GCGR	P47871	3/20	0.58

▸	CALCA	P06881	2/20	0.58

▸	KEAP1	Q14145	1/20	0.58

▸	CTSL	P07711	1/20	0.57

▸	CTSH	P09668	1/20	0.57

▸	CTSS	P25774	1/20	0.57

▸	CTSK	P43235	1/20	0.57

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
SCHEMBL30881892	0.89	C5AR1 (0.70)	C5AR1CXCR4NPY1RNPY2RNPY4R
SCHEMBL29599666	0.89	GLP1R (0.70)	C5AR1NPY1RNPY2RNPY4RNPY5R
SCHEMBL30607317	0.88	KEAP1 (0.67)	C5AR1CXCR4NPY1RNPY2RNPY4R
SCHEMBL30429341	0.88	GLP1R (0.68)	C5AR1CXCR4NPY1RNPY2RNPY4R
SCHEMBL29965030	0.88	C5AR1 (0.74)	C5AR1CXCR4NPY1RNPY2RNPY4R
SCHEMBL31593288	0.88	C5AR1 (0.63)	C5AR1CXCR4NPY1RNPY2RNPY4R
SCHEMBL30561567	0.87	C5AR1 (0.69)	C5AR1CXCR4NPY1RNPY2RNPY4R
SCHEMBL30859276	0.87	NPY1R (0.65)	C5AR1CXCR4NPY1RNPY2RNPY4R
SCHEMBL29655872	0.87	CXCR4 (0.67)	C5AR1CXCR4GLP1RGCGRKEAP1
SCHEMBL3060138	0.86	C5AR1 (0.73)	C5AR1CXCR4GLP1RKEAP1

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-116019766-A	Amino acid polypeptide antibacterial gel and preparation method and application thereof	陕西文锐医疗器械有限公司	2023-04-28	—	—	CN	disclosed