SCHEMBL29619350

SCHEMBL29619350

CSCC[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 6/20 0.45
▸ CTSD P07339 2/20 0.45
▸ FOLH1 Q04609 1/20 0.44
▸ FURIN P09958 1/20 0.43
▸ PCSK6 P29122 1/20 0.43
▸ NPY1R P25929 1/20 0.42
▸ NPY2R P49146 1/20 0.42
▸ NPY4R P50391 1/20 0.42
▸ FNTA P49354 5/20 0.41
▸ FNTB P49356 5/20 0.41
▸ OPRK1 P41145 1/20 0.40
▸ BACE2 Q9Y5Z0 1/20 0.39

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
SCHEMBL31753464 0.91 FOLH1 (0.53) FOLH1NPY1RNPY2RNPY4RFNTA
SCHEMBL30052935 0.91 BACE1 (0.48) BACE1CTSDFOLH1FNTAFNTB
SCHEMBL30890810 0.90 FOLH1 (0.52) BACE1CTSDFOLH1NPY1RNPY2R
SCHEMBL30400254 0.90 FOLH1 (0.54) FOLH1NPY1RNPY2RNPY4RFNTA
SCHEMBL10596623 0.90 OPRK1 (0.55) BACE1CTSDNPY1RNPY2RNPY4R
SCHEMBL31663474 0.89 BACE1 (0.51) BACE1CTSDFNTAFNTB
SCHEMBL31010532 0.89 BACE1 (0.48) BACE1CTSDFURINPCSK6FNTA
SCHEMBL30629771 0.89 NPY4R (0.45) BACE1CTSDFURINPCSK6NPY1R
SCHEMBL30495535 0.88 FNTA (0.51) BACE1FOLH1FNTAFNTB
SCHEMBL30401136 0.86 FOLH1 (0.51) BACE1CTSDFOLH1NPY1RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114835773-A ACE inhibitory peptide and application thereof 浙江海洋大学 2022-08-02 — — CN disclosed
CN-114835773-A ACE inhibitory peptide and application thereof 浙江海洋大学 2022-08-02 — — CN disclosed
CN-112521446-B ACE inhibitory peptide and application thereof 浙江海洋大学 2022-06-21 — — CN disclosed
CN-112521446-B ACE inhibitory peptide and application thereof 浙江海洋大学 2022-06-21 — — CN disclosed
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