Levacetylleucine

Levacetylleucine

SCHEMBL9438432

CC(=O)N[C@@H](CC(C)C)C(=O)O.[GaH3]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 1.00
▸ MEN1 O00255 1/20 0.64
▸ LMNA P02545 1/20 0.64
▸ KMT2A Q03164 1/20 0.64
▸ MAPT P10636 2/20 0.60
▸ KDM4E B2RXH2 1/20 0.59
▸ THRB P10828 1/20 0.59
▸ ALOX15 P16050 1/20 0.59
▸ NFKB1 P19838 1/20 0.59
▸ PTGS2 P35354 1/20 0.59
▸ THPO P40225 1/20 0.59
▸ RECQL P46063 1/20 0.59
▸ BLM P54132 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ FOLH1 Q04609 9/20 0.56
▸ LAP3 P28838 3/20 0.53
▸ NAALAD2 Q9Y3Q0 2/20 0.52
▸ PLA2G2A P14555 2/20 0.50
▸ PLA2G5 P39877 2/20 0.50
▸ GRN P28799 1/20 0.50

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
Levacetylleucine SCHEMBL714003 1.00 ALDH1A1 (1.00) ALDH1A1MEN1LMNAKMT2AMAPT
Acetylleucine SCHEMBL282371 1.00 ALDH1A1 (1.00) ALDH1A1MEN1LMNAKMT2AMAPT
Levacetylleucine SCHEMBL282372 1.00 ALDH1A1 (1.00) ALDH1A1MEN1LMNAKMT2AMAPT
Levacetylleucine SCHEMBL5532016 0.98 ALDH1A1 (0.96) ALDH1A1MEN1LMNAKMT2AMAPT
Levacetylleucine SCHEMBL5527234 0.98 ALDH1A1 (0.96) ALDH1A1MEN1LMNAKMT2AMAPT
Levacetylleucine SCHEMBL7923132 0.98 ALDH1A1 (0.96) ALDH1A1MEN1LMNAKMT2AMAPT
Levacetylleucine SCHEMBL18954336 0.98 ALDH1A1 (0.96) ALDH1A1MEN1LMNAKMT2AMAPT
Acetylleucine SCHEMBL25408262 0.94 ALDH1A1 (0.88) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL5551897 0.92 ALDH1A1 (0.85) ALDH1A1MEN1LMNAKMT2AMAPT
SCHEMBL17948650 0.92 ALDH1A1 (0.85) ALDH1A1MEN1LMNAKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5358705-A For reducing or preventing dental plaque or oral diseases, dentifrices, mouthwashes THE PROCTER & GAMBLE COMPANY (US) 1994-10-25 — — US disclosed
US-5286480-A Reducing dental plaque coating on teeth THE PROCTER & GAMBLE COMPANY (US) 1994-02-15 — — US disclosed
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