SCHEMBL31129152

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](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc2ccccc2c1)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 0.66

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	NMUR2	Q9GZQ4	5/20	0.64

▸	NMUR1	Q9HB89	5/20	0.64

▸	NPY2R	P49146	8/20	0.57

▸	NPY4R	P50391	8/20	0.57

▸	NPY5R	Q15761	8/20	0.57

▸	NPY1R	P25929	6/20	0.57

▸	OPRD1	P41143	1/20	0.57

▸	TFPI	P10646	2/20	0.55

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
SCHEMBL31129139	0.98	NMUR2 (0.65)	NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL31129140	0.96	NMUR2 (0.66)	NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL31129144	0.96	NPY2R (0.59)	NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL31129148	0.95	NPY2R (0.60)	NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL31129135	0.95	NPY2R (0.60)	NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL31129128	0.94	NPY2R (0.61)	NPY2RNPY4RNPY5RNPY1ROPRD1
SCHEMBL31129149	0.93	NPY2R (0.63)	NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL31129147	0.93	NPY2R (0.61)	NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL31129151	0.92	NPY2R (0.65)	NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL31633302	0.91	NPY2R (0.63)	NMUR2NMUR1NPY2RNPY4RNPY5R

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