Malic Acid

Malic Acid

SCHEMBL28083031

C=C(C)C(=O)O.O=C(O)CC(O)C(=O)O.[NaH]

nearest known ligand 0.65

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Known targets — ChEMBL curated mechanism

CACNA1CCACNA1DCACNA1FCACNA1SDRD2HTR1BHTR1DHTR1F

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

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.65
TET2 Q6N021 6/20 0.56
TET3 O43151 2/20 0.56
TET1 Q8NFU7 1/20 0.56
SLC22A6 Q4U2R8 1/20 0.39
KDM4A O75164 2/20 0.38
KDM4C Q9H3R0 2/20 0.38
KDM2A Q9Y2K7 2/20 0.38
OR51E2 Q9H255 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GRIK1 P39086 1/20 0.34
GRIK2 Q13002 1/20 0.34
GRM1 Q13255 1/20 0.34
GRM2 Q14416 1/20 0.34
MAPT P10636 1/20 0.34
TGFBR1 P36897 1/20 0.34
GABRR1 P24046 1/20 0.33
GPR84 Q9NQS5 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
Malic Acid SCHEMBL18939741 0.98 SMN1; SMN2 (0.68) SMN1; SMN2TET2TET3TET1SLC22A6
Malic Acid SCHEMBL28082794 0.96 SMN1; SMN2 (0.65) SMN1; SMN2TET2TET3TET1SLC22A6
Malic Acid SCHEMBL28082535 0.96 SMN1; SMN2 (0.65) SMN1; SMN2TET2TET3TET1SLC22A6
Malic Acid SCHEMBL28082875 0.96 SMN1; SMN2 (0.65) SMN1; SMN2TET2TET3TET1SLC22A6
Malic Acid SCHEMBL28082942 0.96 SMN1; SMN2 (0.65) SMN1; SMN2TET2TET3TET1SLC22A6
Malic Acid SCHEMBL3771501 0.91 SMN1; SMN2 (0.71) SMN1; SMN2TET2TET3TET1SLC22A6
Malic Acid SCHEMBL28494369 0.88 SMN1; SMN2 (0.56) SMN1; SMN2TET2TET3TET1SLC22A6
Malic Acid SCHEMBL28063324 0.85 SMN1; SMN2 (0.52) SMN1; SMN2TET2TET3TET1SLC22A6
Malic Acid SCHEMBL585339 0.84 SMN1; SMN2 (0.75) SMN1; SMN2TET2TET3TET1SLC22A6
Malic Acid SCHEMBL409860 0.84 SMN1; SMN2 (0.83) SMN1; SMN2TET2TET3TET1SLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105814092-B Composition for hydrophilic cured product 三井化学株式会社 2018-09-21 CN disclosed
CN-107430213-A Hydrophilic optical feature monofilm and its layered product 三井化学株式会社 2017-12-01 CN disclosed
CN-105814092-A Composition for hydrophilic cured product 三井化学株式会社 2016-07-27 CN disclosed