Threonine

Threonine

SCHEMBL4493265

C[C@@H](O)[C@H](N)C(=O)O.C[C@@H](O)[C@H](N)C(=O)O.N[C@@H](CS)C(=O)O

nearest known ligand 0.67

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Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.67
SLC7A11 Q9UPY5 1/20 0.67
SLC7A5 Q01650 2/20 0.45
ENPEP Q07075 4/20 0.44
SLC1A3 P43003 4/20 0.41
SLC1A2 P43004 4/20 0.41
SLC1A1 P43005 3/20 0.41
ALDH1A1 P00352 1/20 0.36
USP2 O75604 1/20 0.36
SLCO1B1 Q9Y6L6 1/20 0.36
GRIK1 P39086 2/20 0.36
GRIA2 P42262 2/20 0.36
GRIA4 P48058 2/20 0.36
GRIK3 Q13003 2/20 0.36
GRIK5 Q16478 2/20 0.36
GRIA1 P42261 1/20 0.36
GRIK2 Q13002 1/20 0.36

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 SCHEMBL971052 1.00 PTGS1 (0.67) PTGS1SLC7A11SLC7A5ENPEPSLC1A3
Threonine SCHEMBL27769582 1.00 PTGS1 (0.67) PTGS1SLC7A11SLC7A5ENPEPSLC1A3
Threonine SCHEMBL971053 1.00 PTGS1 (0.67) PTGS1SLC7A11SLC7A5ENPEPSLC1A3
Threonine SCHEMBL6391173 0.93 PTGS1 (0.57) PTGS1SLC7A11SLC7A5ENPEPSLC1A3
Threonine SCHEMBL6391172 0.93 PTGS1 (0.57) PTGS1SLC7A11SLC7A5ENPEPSLC1A3
Threonine SCHEMBL23883208 0.93 PTGS1 (0.57) PTGS1SLC7A11SLC7A5ENPEPSLC1A3
Leucine SCHEMBL3495955 0.91 SLC7A5 (0.62) PTGS1SLC7A11SLC7A5ENPEPSLC1A3
Isoleucine SCHEMBL3374935 0.89 PTGS1 (0.53) PTGS1SLC7A11SLC7A5ENPEPSLC1A3
Cystine SCHEMBL9051990 0.89 PTGS1 (0.53) PTGS1SLC7A11SLC7A5ENPEPSLC1A3
Threonine SCHEMBL17559245 0.89 PTGS1 (0.53) PTGS1SLC7A11SLC7A5ENPEPSLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7592188-B2 environmentally sensitive fluorescent dye covalently linked to a binding domain which has specific affinity for a target molecule; fluorescence resonance energy transfer; detecting changes in the binding, conformational change; detecting human immunodeficiency virus THE SCRIPPS RESEARCH INSTITUTE (US) 2009-09-22 US disclosed
EP-1735453-A2 FLUORESCENT SIGNAL EMITTING LIVE CELL BIOSENSOR MOLECULES AND DYES FOR DETECTION AND QUANTIFICATION OF PROTEIN ACTIVITIES The Scripps Research Institute (US) 2006-12-27 EP disclosed
US-20060029946-A1 Live cell biosensors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2006-02-09 US disclosed
WO-2005088308-A2 FLUORESCENT SIGNAL EMITTING LIVE CELL BIOSENSOR MOLECULES AND DYES FOR DETECTION AND QUANTIFICATION OF PROTEIN ACTIVITIES THE SCRIPPS RESEARCH INSTITUTE (US) 2005-09-22 WO disclosed