SCHEMBL29702111

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CN)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	F2	P00734	4/20	0.61

▸	NTSR1	P30989	3/20	0.58

▸	NTSR2	O95665	1/20	0.58

▸	APLNR	P35414	1/20	0.57

▸	NPY2R	P49146	7/20	0.56

▸	NPY4R	P50391	7/20	0.56

▸	NPY5R	Q15761	7/20	0.56

▸	NPY1R	P25929	5/20	0.56

▸	NMUR2	Q9GZQ4	2/20	0.56

▸	NMUR1	Q9HB89	2/20	0.56

▸	MAPK8	P45983	1/20	0.55

▸	MAPK9	P45984	1/20	0.55

▸	MAPK10	P53779	1/20	0.55

▸	C5AR1	P21730	1/20	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
SCHEMBL29702101	0.97	F2 (0.58)	F2NTSR1NTSR2APLNRNPY2R
Apidaecin Ia SCHEMBL31694517	0.93	F2 (0.58)	F2APLNRNPY2RNPY4RNPY5R
SCHEMBL31658157	0.91	C5AR1 (0.58)	F2NTSR1NTSR2APLNRNPY2R
SCHEMBL31544391	0.90	AGTR1 (0.62)	F2NTSR1NTSR2APLNRNMUR2
SCHEMBL30176467	0.89	CALCR (0.65)	F2NPY2RNPY4RNPY5RNPY1R
SCHEMBL29679646	0.89	F2 (0.61)	F2APLNRNPY2RNPY4RNPY5R
SCHEMBL29903333	0.88	APLNR (0.61)	F2NTSR1NTSR2APLNRNPY2R
SCHEMBL31332156	0.88	AGTR2 (0.64)	F2NTSR1NTSR2APLNRNPY1R
Apidaecin SCHEMBL29380656	0.88	NPY4R (0.67)	NPY2RNPY4RNPY5RNPY1R
SCHEMBL29359023	0.88	AGTR2 (0.66)	F2NTSR1NTSR2APLNRC5AR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-114539359-A	Antibacterial peptide for preventing and treating chalk brood of bee larvae, preparation method and application thereof	中国农业科学院蜜蜂研究所	2022-05-27	—	—	CN	claimed
CN-114539359-A	Antibacterial peptide for preventing and treating chalk brood of bee larvae, preparation method and application thereof	中国农业科学院蜜蜂研究所	2022-05-27	—	—	CN	disclosed