SCHEMBL31129151

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(C)C)C(C)C)C(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC)C(C)C

nearest known ligand 0.74

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	8/20	0.65

▸	NPY4R	P50391	8/20	0.65

▸	NPY5R	Q15761	8/20	0.65

▸	NPY1R	P25929	6/20	0.65

▸	TFPI	P10646	4/20	0.62

▸	NMUR2	Q9GZQ4	3/20	0.60

▸	NMUR1	Q9HB89	3/20	0.60

▸	CXCR4	P61073	1/20	0.60

▸	MAPK8	P45983	1/20	0.59

▸	MAPK9	P45984	1/20	0.59

▸	MAPK10	P53779	1/20	0.59

▸	CALCR	P30988	1/20	0.58

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
SCHEMBL31129149	0.98	NPY2R (0.63)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31129128	0.97	NPY2R (0.61)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31129147	0.97	NPY2R (0.61)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31129135	0.96	NPY2R (0.60)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31129148	0.96	NPY2R (0.60)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31129140	0.96	NMUR2 (0.66)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31633302	0.96	NPY2R (0.63)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30105815	0.96	NPY2R (0.63)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31129139	0.94	NMUR2 (0.65)	NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31129152	0.92	NMUR2 (0.64)	NPY2RNPY4RNPY5RNPY1RTFPI

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-118745209-A	Stable antibacterial peptide in blood plasma and preparation method and application thereof	国家纳米科学中心	2024-10-08	—	—	CN	disclosed