SCHEMBL30641911

SCHEMBL30641911

N=C(N)NCCC[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 4/20 0.49
▸ ACE P12821 2/20 0.49
▸ ERAP1 Q9NZ08 3/20 0.48
▸ LNPEP Q9UIQ6 3/20 0.48
▸ NPY1R P25929 2/20 0.48
▸ NPY2R P49146 2/20 0.48
▸ NPY4R P50391 2/20 0.48
▸ GHSR Q92847 1/20 0.48
▸ KISS1R Q969F8 2/20 0.47
▸ MAGI3 Q5TCQ9 1/20 0.47

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
SCHEMBL30641907 0.98 NPY1R (0.50) ERAP2ACENPY1RNPY2RNPY4R
SCHEMBL30641908 0.98 NPY1R (0.50) ERAP2ACENPY1RNPY2RNPY4R
SCHEMBL30641912 0.98 NPY1R (0.50) ERAP2ACENPY1RNPY2RNPY4R
SCHEMBL30958346 0.97 GHSR (0.49) ERAP2ACENPY1RNPY2RNPY4R
SCHEMBL31735183 0.95 ERAP2 (0.55) ERAP2ACEERAP1LNPEPNPY1R
SCHEMBL30085020 0.95 ACE (0.52) ERAP2ACEERAP1LNPEPNPY1R
SCHEMBL29577026 0.95 ACE (0.52) ERAP2ACEERAP1LNPEPNPY1R
SCHEMBL30200105 0.95 ACE (0.52) ERAP2ACEERAP1LNPEPNPY1R
SCHEMBL29732555 0.94 NPY1R (0.53) ERAP2ACEERAP1LNPEPNPY1R
SCHEMBL30305296 0.94 NPY1R (0.53) ERAP2ACEERAP1LNPEPNPY1R

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-117024515-A Polypeptide and application thereof in pharmacy 沈旭 2023-11-10 — — CN disclosed
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