SCHEMBL30662552

SCHEMBL30662552

N=C(N)NCCC[C@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC(=O)O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 6/20 0.42
▸ FNTA P49354 2/20 0.39
▸ FNTB P49356 2/20 0.39
▸ PGGT1B P53609 1/20 0.39
▸ C3AR1 Q16581 1/20 0.37
▸ NPY4R P50391 6/20 0.37
▸ NPY1R P25929 5/20 0.37
▸ NPY2R P49146 5/20 0.37
▸ NPY5R Q15761 5/20 0.37
▸ PTGS1 P23219 1/20 0.37
▸ GSTK1 Q9Y2Q3 1/20 0.37
▸ GNPAT O15228 2/20 0.36
▸ OPRM1 P35372 1/20 0.35
▸ OPRD1 P41143 1/20 0.35
▸ OPRK1 P41145 1/20 0.35

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
SCHEMBL29415209 0.98 NOD1 (0.43) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL29630329 0.92 NOD1 (0.49) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL32684785 0.92 NOD1 (0.49) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL29880860 0.91 GNPAT (0.41) NOD1C3AR1NPY4RNPY1RNPY2R
SCHEMBL17748347 0.91 NOD1 (0.43) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL17748346 0.91 NOD1 (0.43) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL29539524 0.89 NOD1 (0.42) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL27632323 0.89 NOD1 (0.51) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL27632326 0.89 NOD1 (0.51) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL31099287 0.89 NOD1 (0.45) NOD1FNTAFNTBPGGT1BNPY4R

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-117106016-A Donkey-hide gelatin source tyrosinase inhibitory peptide and application thereof 海南大学 2023-11-24 — — CN claimed
CN-117106016-A Donkey-hide gelatin source tyrosinase inhibitory peptide and application thereof 海南大学 2023-11-24 — — CN disclosed
CN-117106016-A Donkey-hide gelatin source tyrosinase inhibitory peptide and application thereof 海南大学 2023-11-24 — — CN disclosed
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