SCHEMBL30441296

SCHEMBL30441296

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

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 1/20 0.52
▸ CAPN1 P07384 6/20 0.45
▸ CTSB P07858 1/20 0.45
▸ SLC6A2 P23975 2/20 0.44
▸ F2 P00734 1/20 0.42
▸ F10 P00742 1/20 0.42
▸ PLG P00747 1/20 0.42
▸ PRSS1 P07477 1/20 0.42
▸ GRB2 P62993 1/20 0.41
▸ CALCRL Q16602 1/20 0.41
▸ PDCD1LG2 Q9BQ51 1/20 0.41
▸ CD274 Q9NZQ7 1/20 0.41
▸ NPY1R P25929 1/20 0.41
▸ NPY2R P49146 1/20 0.41
▸ NPY4R P50391 1/20 0.41
▸ NPY5R Q15761 1/20 0.41
▸ DPP3 Q9NY33 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
SCHEMBL29630674 0.90 CAPN1 (0.53) XIAPCAPN1CTSBSLC6A2GRB2
SCHEMBL29630819 0.89 XIAP (0.47) XIAPCAPN1CTSBSLC6A2F2
SCHEMBL29530605 0.87 XIAP (0.49) XIAPCAPN1CTSBSLC6A2GRB2
SCHEMBL29530904 0.85 XIAP (0.48) XIAPCAPN1SLC6A2F2GRB2
SCHEMBL29530598 0.85 XIAP (0.53) XIAPCAPN1CTSBSLC6A2CALCRL
SCHEMBL30390685 0.85 XIAP (0.55) XIAPCAPN1CTSBSLC6A2CALCRL
SCHEMBL31257024 0.85 GRB2 (0.49) XIAPCAPN1CTSBSLC6A2GRB2
SCHEMBL24419898 0.84 XIAP (0.54) XIAPCAPN1CTSBSLC6A2
SCHEMBL34461107 0.84 XIAP (0.54) XIAPCAPN1CTSBSLC6A2
SCHEMBL30866244 0.84 XIAP (0.54) XIAPCAPN1CTSBSLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112004929-B Method for producing protein by secretion 味之素株式会社 2024-03-15 — — CN disclosed
CN-110312807-B Method for producing protein by secretion 味之素株式会社 2023-11-17 — — CN disclosed
CN-109937258-B Method for producing protein by secretion 味之素株式会社 2023-06-23 — — CN disclosed
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