SCHEMBL29655840

N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)NCC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	PTGS1	P23219	1/20	0.44

▸	GSTK1	Q9Y2Q3	1/20	0.44

▸	NPY4R	P50391	14/20	0.42

▸	NPY1R	P25929	8/20	0.42

▸	NPY5R	Q15761	6/20	0.42

▸	NPY2R	P49146	5/20	0.42

▸	GLO1	Q04760	1/20	0.42

▸	NOD1	Q9Y239	2/20	0.41

▸	DPP7	Q9UHL4	1/20	0.38

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
SCHEMBL29655812	1.00	PTGS1 (0.44)	PTGS1GSTK1NPY4RNPY1RNPY5R
SCHEMBL29655852	1.00	PTGS1 (0.44)	PTGS1GSTK1NPY4RNPY1RNPY5R
SCHEMBL29533359	1.00	PTGS1 (0.44)	PTGS1GSTK1NPY4RNPY1RNPY5R
SCHEMBL29655791	1.00	PTGS1 (0.44)	PTGS1GSTK1NPY4RNPY1RNPY5R
SCHEMBL29590332	0.98	PTGS1 (0.43)	PTGS1GSTK1NPY4RNPY1RNPY5R
SCHEMBL19791172	0.95	PTGS1 (0.41)	PTGS1GSTK1NPY4RNPY1RNPY5R
SCHEMBL30254242	0.94	GNAI3 (0.43)	PTGS1GSTK1NPY4RNPY1RNPY5R
SCHEMBL7306618	0.93	PTGS1 (0.43)	PTGS1GSTK1NPY4RNPY1RNPY5R
SCHEMBL29630413	0.93	PTGS1 (0.43)	PTGS1GSTK1NPY4RNPY1RNPY5R
SCHEMBL31691755	0.92	NPY4R (0.44)	PTGS1GSTK1NPY4RNPY1RNPY5R

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-110818775-B	Protein and polypeptide protective agent and application thereof	北京双鹭药业股份有限公司	2022-05-10	—	—	CN	disclosed