SCHEMBL30717679

SCHEMBL30717679

CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TASP1 Q9H6P5 1/20 0.47
▸ FOLH1 Q04609 2/20 0.46
▸ BACE1 P56817 13/20 0.43
▸ CTSD P07339 3/20 0.43
▸ GRIN2D O15399 1/20 0.42
▸ GRIN3B O60391 1/20 0.42
▸ GRIN1 Q05586 1/20 0.42
▸ GRIN2A Q12879 1/20 0.42
▸ GRIN2B Q13224 1/20 0.42
▸ GRIN2C Q14957 1/20 0.42
▸ GRIN3A Q8TCU5 1/20 0.42
▸ BACE2 Q9Y5Z0 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
SCHEMBL29416042 0.88 NOD1 (0.46) TASP1FOLH1BACE1CTSDBACE2
SCHEMBL29777830 0.88 MME (0.46) —
SCHEMBL31415962 0.86 FOLH1 (0.49) TASP1FOLH1BACE1GRIN2DGRIN3B
SCHEMBL31666002 0.86 BACE1 (0.45) TASP1BACE1CTSDGRIN2DGRIN3B
SCHEMBL31666003 0.86 BACE1 (0.45) TASP1BACE1CTSDGRIN2DGRIN3B
SCHEMBL31410850 0.85 BACE1 (0.48) BACE1CTSDBACE2
SCHEMBL31307282 0.85 BACE1 (0.58) BACE1CTSDBACE2
SCHEMBL31410828 0.84 BACE1 (0.46) TASP1BACE1CTSD
SCHEMBL29901173 0.84 BACE1 (0.54) FOLH1BACE1CTSDBACE2
SCHEMBL30570973 0.84 FURIN (0.46) FOLH1BACE1CTSDGRIN2DGRIN3B

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-117143185-A Anglerfish skin peptide for resisting lipid nephrotoxicity, and preparation method and application thereof 浙江海洋大学 2023-12-01 — — CN disclosed
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