Malic Acid

Malic Acid

SCHEMBL28486197

C=CCOCC=C.O=C(O)CC(O)C(=O)O.OCCO

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

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 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
TET2 Q6N021 6/20 0.38
TET3 O43151 2/20 0.38
TET1 Q8NFU7 1/20 0.38
OR51E2 Q9H255 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
KDM4A O75164 2/20 0.32
KDM4C Q9H3R0 2/20 0.32
KDM2A Q9Y2K7 2/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
CASP1 P29466 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
Malic Acid SCHEMBL3809544 0.94 SMN1; SMN2 (0.60) SMN1; SMN2TET2TET3TET1OR51E2
Malic Acid SCHEMBL15877626 0.81 SMN1; SMN2 (0.68) SMN1; SMN2TET2TET3TET1OR51E2
Malic Acid SCHEMBL28317492 0.80 SMN1; SMN2 (0.83) SMN1; SMN2TET2TET3TET1OR51E2
Malic Acid SCHEMBL27748793 0.80 SMN1; SMN2 (0.83) SMN1; SMN2TET2TET3TET1OR51E2
Malic Acid SCHEMBL9617104 0.80 SMN1; SMN2 (0.47) SMN1; SMN2TET2TET3TET1CA1
Malic Acid SCHEMBL367943 0.80 SMN1; SMN2 (0.56) SMN1; SMN2TET2TET3TET1OR51E2
SCHEMBL8003148 0.80 SMN1; SMN2 (0.40) SMN1; SMN2CA1CA2CA7SLC22A6
Bicarbonate SCHEMBL10456880 0.78 CA1 (0.37) SMN1; SMN2CA1CA2CA7TDP1
SCHEMBL18604307 0.77 CA1 (0.52) SMN1; SMN2TET2TET3TET1OR51E2
Malic Acid SCHEMBL10337063 0.76 SMN1; SMN2 (0.75) SMN1; SMN2TET2TET3TET1OR51E2

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
CN-111732685-B Water-absorbent resin composition, water-absorbent resin and process for producing the same 台湾塑胶工业股份有限公司 2022-02-15 CN disclosed
CN-111732685-A Water-absorbent resin composition, water-absorbent resin and process for producing the same 台湾塑胶工业股份有限公司 2020-10-02 CN disclosed