Threonine

Threonine

SCHEMBL8429461

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nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Threonine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.38
GLRA1 P23415 1/20 0.34
SLC6A9 P48067 1/20 0.34
OR51E2 Q9H255 1/20 0.34
SLC1A3 P43003 3/20 0.33
SLC1A2 P43004 3/20 0.33
SLC1A1 P43005 3/20 0.33
USP2 O75604 1/20 0.32
SLCO1B1 Q9Y6L6 1/20 0.32
GABRP O00591 2/20 0.31
GABRD O14764 2/20 0.31
GABRA1 P14867 2/20 0.31
GABRB1 P18505 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
GABRA5 P31644 2/20 0.31
GABRA3 P34903 2/20 0.31
GABRA2 P47869 2/20 0.31
GABRB2 P47870 2/20 0.31
GABRA4 P48169 2/20 0.31

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
Threonine SCHEMBL5073181 0.89 SLC7A5 (0.46) SLC7A5GLRA1SLC6A9OR51E2SLC1A3
Threonine SCHEMBL5073185 0.89 SLC7A5 (0.46) SLC7A5GLRA1SLC6A9OR51E2SLC1A3
Threonine SCHEMBL8429463 0.89 SLC7A5 (0.46) SLC7A5GLRA1SLC6A9OR51E2SLC1A3
Threonine SCHEMBL6856750 0.89 SLC7A5 (0.46) SLC7A5GLRA1SLC6A9OR51E2SLC1A3
Threonine SCHEMBL4451758 0.89 SLC7A5 (0.46) SLC7A5SLC1A3SLC1A2SLC1A1USP2
Threonine SCHEMBL6856748 0.88 SLC7A5 (0.36) SLC7A5SLC1A3SLC1A2SLC1A1USP2
Threonine SCHEMBL5073183 0.86 SLC7A5 (0.38) SLC7A5SLC1A3SLC1A2SLC1A1USP2
Threonine SCHEMBL18729492 0.85 SLC7A5 (0.50) SLC7A5GLRA1SLC6A9OR51E2SLC1A3
Threonine SCHEMBL442279 0.85 SLC7A5 (0.50) SLC7A5GLRA1SLC6A9OR51E2SLC1A3
Threonine SCHEMBL2765875 0.85 SLC7A5 (0.50) SLC7A5GLRA1SLC6A9OR51E2SLC1A3

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-5859187-A Antiviral peptides E. R. SQUIBB & SONS, INC. (US) 1999-01-12 US claimed
US-5859187-A Antiviral peptides E. R. SQUIBB & SONS, INC. (US) 1999-01-12 US disclosed