Malonic Acid

Malonic Acid

SCHEMBL27832197

O=C(O)CC(=O)O.O=C1CC(S(=O)(=O)O)C(=O)N1

nearest known ligand 0.35

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 2/20 0.35
ITGA5 P08648 2/20 0.35
ITGB3 P05106 1/20 0.35
ITGB2 P05107 1/20 0.35
ITGAV P06756 1/20 0.35
ITGA2B P08514 1/20 0.35
ITGB5 P18084 1/20 0.35
ITGAL P20701 1/20 0.35
MAP3K14 Q99558 1/20 0.34
CRBN Q96SW2 2/20 0.32
LDHA P00338 1/20 0.31
SRR Q9GZT4 1/20 0.31
DDB1 Q16531 1/20 0.31
MEN1 O00255 1/20 0.30
APEX1 P27695 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
KDM4E B2RXH2 1/20 0.30
TSHR P16473 1/20 0.30

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
Succinic Acid SCHEMBL27811641 0.90 ITGB3 (0.35) ITGB1ITGA5ITGB3ITGB2ITGAV
Succinic Acid SCHEMBL29098926 0.90 ITGB3 (0.35) ITGB1ITGA5ITGB3ITGB2ITGAV
Bicarbonate SCHEMBL28576915 0.89 MAP3K14 (0.39) ITGB1ITGA5ITGB3ITGB2ITGAV
Propionic Acid SCHEMBL22749332 0.88 CRBN (0.35) ITGB1ITGA5ITGB3ITGB2ITGAV
SCHEMBL36369 0.87 MAP3K14 (0.43) MAP3K14CRBNDDB1MEN1APEX1
Glutarate SCHEMBL27798405 0.87 SLC22A6 (0.35) ITGB1ITGA5ITGB3ITGB2ITGAV
Glutarate SCHEMBL29043319 0.87 SLC22A6 (0.35) ITGB1ITGA5ITGB3ITGB2ITGAV
SCHEMBL30158537 0.85 MAP3K14 (0.41) MAP3K14CRBNDDB1MEN1APEX1
SCHEMBL4226226 0.85 MAP3K14 (0.41) MAP3K14CRBNDDB1MEN1APEX1
SCHEMBL5086277 0.85 MAP3K14 (0.41) MAP3K14CRBNDDB1MEN1APEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102308206-A Self-actuating signal producing detection devices and methods SIOMETRIX CORP 2012-01-04 CN disclosed