SCHEMBL30562642

SCHEMBL30562642

CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 3/20 0.52
▸ ITGB3 P05106 2/20 0.47
▸ ITGA2B P08514 2/20 0.47
▸ SLC15A2 Q16348 1/20 0.47
▸ NOD1 Q9Y239 8/20 0.44
▸ APLNR P35414 2/20 0.43
▸ TLR2 O60603 1/20 0.41
▸ GRIA1 P42261 1/20 0.39
▸ NMT2 O60551 1/20 0.39
▸ NMT1 P30419 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
SCHEMBL29942005 0.99 SLC6A5 (0.51) SLC6A5ITGB3ITGA2BSLC15A2NOD1
SCHEMBL29941942 0.91 SLC6A5 (0.52) SLC6A5ITGB3ITGA2BSLC15A2NOD1
SCHEMBL30716920 0.91 SLC6A5 (0.52) SLC6A5ITGB3ITGA2BSLC15A2NOD1
SCHEMBL322731 0.90 SLC6A5 (0.52) SLC6A5ITGB3ITGA2BSLC15A2NOD1
SCHEMBL1163474 0.90 SLC6A5 (0.52) SLC6A5ITGB3ITGA2BSLC15A2NOD1
SCHEMBL31138844 0.89 SLC6A5 (0.50) SLC6A5ITGB3ITGA2BSLC15A2NOD1
SCHEMBL29942896 0.87 APLNR (0.53) NOD1APLNR
SCHEMBL30562699 0.87 APLNR (0.53) NOD1APLNR
SCHEMBL29467847 0.86 SLC6A5 (0.49) SLC6A5ITGB3ITGA2BSLC15A2NOD1
SCHEMBL29802232 0.86 SLC15A2 (0.55) SLC6A5ITGB3ITGA2BSLC15A2NMT2

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-110769862-B Non-viral gene delivery agents comprising Lipopeptide (LP) compounds 莫纳什大学 2023-09-12 — — CN disclosed
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