SCHEMBL29642947

N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCCN)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	TFPI	P10646	1/20	0.44

▸	NMT1	P30419	5/20	0.43

▸	NMT2	O60551	4/20	0.43

▸	OPRL1	P41146	2/20	0.43

▸	NPY1R	P25929	2/20	0.42

▸	NPY2R	P49146	2/20	0.42

▸	NPY4R	P50391	2/20	0.42

▸	NPY5R	Q15761	2/20	0.42

▸	CXCR4	P61073	1/20	0.41

▸	KEAP1	Q14145	1/20	0.41

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
SCHEMBL31410685	0.97	NPY4R (0.43)	TFPINMT1NMT2OPRL1NPY1R
SCHEMBL31211745	0.96	FOLH1 (0.45)	TFPINMT1NMT2OPRL1NPY1R
SCHEMBL29489381	0.96	OPRL1 (0.44)	TFPINMT1NMT2OPRL1NPY1R
SCHEMBL31343536	0.93	NPY4R (0.45)	NMT1NMT2OPRL1NPY1RNPY2R
SCHEMBL30880861	0.93	FOLH1 (0.47)	TFPINMT1NMT2NPY1RNPY2R
SCHEMBL31343396	0.93	NPY4R (0.45)	NMT1NMT2OPRL1NPY1RNPY2R
SCHEMBL30521941	0.91	OPRL1 (0.43)	TFPINMT1NMT2OPRL1NPY1R
SCHEMBL13655538	0.91	NMT1 (0.45)	NMT1NMT2OPRL1NPY1RNPY2R
SCHEMBL30084582	0.91	FOLH1 (0.48)	NMT1NMT2NPY1RNPY2RNPY4R
SCHEMBL29769803	0.91	FOLH1 (0.48)	NMT1NMT2NPY1RNPY2RNPY4R

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-113069416-B	Active targeting amphiphilic polypeptide composite nano micelle prodrug and preparation and application thereof	华中科技大学	2022-05-17	—	—	CN	disclosed