SCHEMBL30785952

SCHEMBL30785952

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O)C(C)C

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 1/20 0.54
▸ CAPN1 P07384 4/20 0.45
▸ CTSB P07858 1/20 0.45
▸ NPY1R P25929 2/20 0.44
▸ NPY2R P49146 1/20 0.44
▸ NPY4R P50391 1/20 0.44
▸ NPY5R Q15761 1/20 0.44
▸ NTSR2 O95665 5/20 0.43
▸ NTSR1 P30989 5/20 0.43
▸ ELANE P08246 3/20 0.43
▸ SORT1 Q99523 4/20 0.42
▸ CMA1 P23946 1/20 0.41
▸ REN P00797 1/20 0.41

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
SCHEMBL30422499 0.89 XIAP (0.55) XIAPNTSR2NTSR1SORT1REN
SCHEMBL30604719 0.85 XIAP (0.54) XIAPCAPN1CTSBNTSR2NTSR1
SCHEMBL31226653 0.84 XIAP (0.56) XIAPCAPN1CTSBNPY1RNPY2R
SCHEMBL31518666 0.84 XIAP (0.47) XIAPCAPN1CTSB
SCHEMBL30051358 0.84 ACE (0.48) XIAPREN
SCHEMBL29569025 0.83 NTSR2 (0.52) XIAPCAPN1NTSR2NTSR1SORT1
SCHEMBL5524248 0.81 CAPN1 (0.53) XIAPCAPN1CTSBNTSR2NTSR1
SCHEMBL5524245 0.81 CAPN1 (0.53) XIAPCAPN1CTSBNTSR2NTSR1
SCHEMBL20250609 0.81 XIAP (0.58) XIAP
SCHEMBL30051223 0.81 XIAP (0.58) XIAP

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117551170-B ACE (angiotensin converting enzyme) inhibitory peptide as well as preparation method and application thereof 中国科学院烟台海岸带研究所 2024-04-19 — — CN disclosed
CN-117551170-A ACE (angiotensin converting enzyme) inhibitory peptide as well as preparation method and application thereof 中国科学院烟台海岸带研究所 2024-02-13 — — CN disclosed
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