SCHEMBL30767696

SCHEMBL30767696

CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 4/20 0.60
▸ CCKBR P32239 2/20 0.60
▸ NPY1R P25929 1/20 0.59
▸ NPY2R P49146 1/20 0.59
▸ NPY4R P50391 1/20 0.59
▸ NPY5R Q15761 1/20 0.59
▸ NMBR P28336 2/20 0.59
▸ GRPR P30550 2/20 0.59
▸ F2 P00734 4/20 0.59
▸ C5AR1 P21730 1/20 0.58
▸ CALCR P30988 4/20 0.58
▸ CXCR4 P61073 1/20 0.57
▸ CTSL P07711 2/20 0.57
▸ CTSS P25774 2/20 0.57
▸ CTSK P43235 2/20 0.57
▸ CTSH P09668 1/20 0.57
▸ GCGR P47871 1/20 0.56
▸ GIPR P48546 1/20 0.56

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL30767699 0.97 F2 (0.58) GLP1RCCKBRNPY1RNPY2RNPY4R
SCHEMBL30767709 0.96 GLP1R (0.61) GLP1RCCKBRNMBRGRPRF2
SCHEMBL29461511 0.93 GLP1R (0.62) GLP1RCCKBRNPY1RNPY2RNPY4R
SCHEMBL30767712 0.93 F2 (0.58) GLP1RCCKBRNMBRGRPRF2
SCHEMBL30495677 0.90 NPY1R (0.72) GLP1RCCKBRNPY1RNPY2RNPY4R
SCHEMBL30537029 0.90 GLP1R (0.72) GLP1RCCKBRNPY1RNPY2RNPY4R
SCHEMBL31182593 0.87 F2 (0.66) GLP1RCCKBRNPY1RNPY2RNPY4R
SCHEMBL29945131 0.87 NMBR (0.62) GLP1RCCKBRNMBRGRPRC5AR1
SCHEMBL32659744 0.87 C5AR1 (0.67) GLP1RNMBRGRPRF2C5AR1
SCHEMBL31757090 0.87 C5AR1 (0.67) GLP1RNMBRGRPRF2C5AR1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117327152-A Digestion-resistant linear epitope peptide of penaeus vannamei allergen and application thereof 大连工业大学 2024-01-02 — — CN disclosed
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