SCHEMBL31129136

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)N)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 0.58

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	4/20	0.56

▸	C5AR1	P21730	1/20	0.55

▸	NTSR1	P30989	2/20	0.54

▸	NPY2R	P49146	5/20	0.54

▸	NPY4R	P50391	5/20	0.54

▸	NPY5R	Q15761	5/20	0.54

▸	NPY1R	P25929	4/20	0.54

▸	EPHA2	P29317	2/20	0.54

▸	NMUR2	Q9GZQ4	1/20	0.53

▸	NMUR1	Q9HB89	1/20	0.53

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
SCHEMBL31129142	0.97	OPRD1 (0.57)	OPRD1NTSR1NPY2RNPY4RNPY5R
SCHEMBL31129141	0.96	C5AR1 (0.59)	OPRD1C5AR1NTSR1NPY2RNPY4R
SCHEMBL31129138	0.96	OPRD1 (0.61)	OPRD1C5AR1NTSR1NPY2RNPY4R
SCHEMBL31129133	0.96	OPRD1 (0.62)	OPRD1C5AR1NTSR1EPHA2
SCHEMBL31129150	0.94	OPRD1 (0.59)	OPRD1C5AR1NPY2RNPY4RNPY5R
SCHEMBL30872254	0.94	C5AR1 (0.58)	OPRD1C5AR1NPY2RNPY4RNPY5R
SCHEMBL31129143	0.93	OPRD1 (0.57)	OPRD1C5AR1NPY2RNPY4RNPY5R
SCHEMBL31124657	0.93	EPHA2 (0.57)	OPRD1C5AR1NTSR1EPHA2NMUR2
SCHEMBL31296998	0.91	NPY2R (0.57)	OPRD1NTSR1NPY2RNPY4RNPY5R
SCHEMBL31129148	0.90	NPY2R (0.60)	OPRD1NPY2RNPY4RNPY5RNPY1R

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