SCHEMBL29769731

SCHEMBL29769731

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 2/20 0.60
▸ FNTA P49354 3/20 0.57
▸ FNTB P49356 3/20 0.57
▸ PGGT1B P53609 2/20 0.57
▸ MME P08473 2/20 0.56
▸ KMT2A Q03164 1/20 0.54

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
SCHEMBL17465627 0.99 LTA4H (0.61) LTA4HFNTAFNTBPGGT1BMME
SCHEMBL30917374 0.97 FNTA (0.56) LTA4HFNTAFNTBPGGT1BKMT2A
SCHEMBL30051749 0.97 FNTA (0.61) LTA4HFNTAFNTBPGGT1BKMT2A
SCHEMBL29714758 0.94 LTA4H (0.53) LTA4HFNTAFNTBPGGT1BMME
SCHEMBL30051273 0.91 FNTA (0.63) LTA4HFNTAFNTBPGGT1BKMT2A
SCHEMBL21467153 0.91 FNTA (0.55) LTA4HFNTAFNTBPGGT1BMME
Acetic Acid SCHEMBL15201179 0.90 LTA4H (0.56) LTA4HFNTAFNTBPGGT1BMME
Acetic Acid SCHEMBL15201182 0.90 LTA4H (0.56) LTA4HFNTAFNTBPGGT1BMME
SCHEMBL16430978 0.90 LTA4H (0.58) LTA4HFNTAFNTBPGGT1BMME
SCHEMBL907359 0.90 FNTA (0.56) LTA4HFNTAFNTBPGGT1BMME

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-114478692-A Selenium-rich peptide with high antioxidant activity and application thereof 华南农业大学 2022-05-13 — — CN disclosed
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