Alanine

Alanine

SCHEMBL7514201

C1=CCC=CC1.C[C@H](N)C(=O)O

nearest known ligand 0.43

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.43
TP53 P04637 1/20 0.38
SLC1A3 P43003 2/20 0.34
SLC1A2 P43004 2/20 0.34
SLC1A1 P43005 1/20 0.34
LTA4H P09960 1/20 0.34
GABRP O00591 3/20 0.33
GABRD O14764 3/20 0.33
GABRA1 P14867 3/20 0.33
GABRB1 P18505 3/20 0.33
GABRG2 P18507 3/20 0.33
GABRB3 P28472 3/20 0.33
GABRA5 P31644 3/20 0.33
GABRA3 P34903 3/20 0.33
GABRA2 P47869 3/20 0.33
GABRB2 P47870 3/20 0.33
GABRA4 P48169 3/20 0.33
GABRE P78334 3/20 0.33
GABRA6 Q16445 3/20 0.33
GABRG1 Q8N1C3 3/20 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
Valine SCHEMBL869350 0.82 SLC7A5 (0.71) SLC7A5TP53SLC1A3SLC1A2SLC1A1
Alanine SCHEMBL27615995 0.82 SLC7A5 (0.53) SLC7A5TP53SLC1A3SLC1A2SLC1A1
Alanine SCHEMBL21616532 0.82 SLC7A5 (0.53) SLC7A5TP53SLC1A3SLC1A2SLC1A1
Alanine SCHEMBL14764702 0.82 SLC7A5 (0.59) SLC7A5TP53SLC1A3SLC1A2SLC1A1
Alanine SCHEMBL254290 0.82 SLC7A5 (0.59) SLC7A5TP53SLC1A3SLC1A2SLC1A1
Alanine SCHEMBL1332110 0.82
Alanine SCHEMBL2784274 0.82
D-Alanine SCHEMBL614024 0.82 SLC7A5 (0.59) SLC7A5TP53SLC1A3SLC1A2SLC1A1
Alanine SCHEMBL31 0.82
Alanine SCHEMBL452350 0.82 SLC7A5 (0.59) SLC7A5TP53SLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230413828-A1 BIOHERBICIDES FOR CONTROLLING ONE OR MORE PLANT SPECIES AGROSPHERES, INC. 2023-12-28 US claimed
JP-58107191-A None JP disclosed
JP-62263123-A None JP disclosed
US-20230413828-A1 BIOHERBICIDES FOR CONTROLLING ONE OR MORE PLANT SPECIES AGROSPHERES, INC. 2023-12-28 US disclosed
EP-4247160-A1 BIOHERBICIDES FOR CONTROLLING ONE OR MORE PLANT SPECIES Agrospheres, Inc. (US) 2023-09-27 EP disclosed
WO-2022108944-A1 BIOHERBICIDES FOR CONTROLLING ONE OR MORE PLANT SPECIES AGROSPHERES, INC. (US) 2022-05-27 WO disclosed
EP-0906900-B1 A process for preparing optically active 2-hydroxy-methyl-3-phenylpropionic acid AJINOMOTO KK (JP) 2002-01-23 EP disclosed
US-6093846-A BY REACTING WITH SPECIFIED OPTICALLY ACTIVE AMINES SUCH AS CIS-1-AMINO-2-INDANOL IN A SOLVENT, PRODUCING TWO DIASTEREOISOMERIC SALTS OF DIFFERING SOLUBILITY, FRACTIONAL CRYSTALLIZATION AND DECOMPOSING THE SALT WITH ALKALI OR ACID AJINOMOTO CO., INC. (JP) 2000-07-25 US disclosed
US-6028217-A CHEMICAL INTERMEDIATE FOR RENIN INHIBITOR OR ENKEPHALINASE ENZYME INHIBITOR AJINOMOTO CO., INC. (JP) 2000-02-22 US disclosed
EP-0906900-A1 A process for preparing optically active 2-hydroxy-methyl-3-phenylpropionic acid Ajinomoto Co., Inc. (JP) 1999-04-07 EP disclosed
JP-S62263123-A NOVEL IMMUNOSUPPRESSIVE AGENT NIPPON KAYAKU CO LTD 1987-11-16 JP disclosed
JP-S58107191-A PREPARATION OF L-1,4-CYCLOHEXADIENE-1-ALANINE AJINOMOTO CO INC 1983-06-25 JP disclosed