Threonine

Threonine

SCHEMBL26979733

CC(N)C(=O)O.CC(O)C(N)C(=O)O.NC(COC(=O)C(N)CCC(=O)O)C(=O)O.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC5A2

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
QARS1 P47897 1/20 0.33
GRM8 O00222 1/20 0.33
GRM6 O15303 1/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GSR P00390 1/20 0.33
CYP1A2 P05177 1/20 0.33
GRIK1 P39086 1/20 0.33
GRM5 P41594 1/20 0.33
GRIA1 P42261 1/20 0.33
GRIA2 P42262 1/20 0.33
GRIA3 P42263 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
GRIA4 P48058 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIK2 Q13002 1/20 0.33
GRIK3 Q13003 1/20 0.33

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
Glutamic Acid SCHEMBL2592950 0.91 GRM8 (0.38) QARS1GRM8GRM6GRIN2DGRIN3B
Glutamic Acid SCHEMBL7654784 0.88 GRM8 (0.44) GRM8GRM6GRIN2DGRIN3BGSR
D-Glutamate SCHEMBL27639981 0.88 GRM8 (0.44) GRM8GRM6GRIN2DGRIN3BGSR
Proline SCHEMBL8582773 0.85 TLR2 (0.34)
D-Glutamate SCHEMBL27779763 0.84 GRM8 (0.40) GRM8GRM6GRIN2DGRIN3BGSR
D-Glutamate SCHEMBL27546761 0.84 GRM8 (0.36) GRM8GRM6GRIN2DGRIN3BGSR
D-Glutamate SCHEMBL29255769 0.84 CYP1A2 (0.49) GRM8GRM6GRIN2DGRIN3BGSR
Glutamic Acid SCHEMBL8852502 0.84 CYP1A2 (0.49) GRM8GRM6GRIN2DGRIN3BGSR
Valine SCHEMBL18954803 0.84 ALOX15 (0.37)
D-Glutamate SCHEMBL27454805 0.82 GRM8 (0.34) GRM8GRM6GRIN2DGRIN3BGSR

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-20240002447-A1 MODIFIED HUMAN PAPILLOMAVIRUS TYPE 52 L1 PROTEIN AND USE THEREOF INSTITUTE OF BASIC MEDICAL SCIENCES, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2024-01-04 US claimed
US-20240002447-A1 MODIFIED HUMAN PAPILLOMAVIRUS TYPE 52 L1 PROTEIN AND USE THEREOF INSTITUTE OF BASIC MEDICAL SCIENCES, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2024-01-04 US disclosed