Malic Acid

Malic Acid

SCHEMBL9719873

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nearest known ligand 0.75

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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 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.75
TSHR P16473 2/20 0.45
TP53 P04637 1/20 0.45
EGLN1 Q9GZT9 1/20 0.45
EGLN3 Q9H6Z9 1/20 0.45
TET2 Q6N021 6/20 0.44
TET3 O43151 2/20 0.44
TET1 Q8NFU7 1/20 0.44
SLC22A6 Q4U2R8 1/20 0.43
KDM4A O75164 2/20 0.42
KDM4C Q9H3R0 2/20 0.42
KDM2A Q9Y2K7 2/20 0.42
OR51E2 Q9H255 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GABRR1 P24046 2/20 0.37
LMNA P02545 1/20 0.37

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 SCHEMBL646455 1.00 SMN1; SMN2 (0.75) SMN1; SMN2TSHRTP53EGLN1EGLN3
Malic Acid SCHEMBL9719878 1.00 SMN1; SMN2 (0.75) SMN1; SMN2TSHRTP53EGLN1EGLN3
Malic Acid SCHEMBL27302361 1.00 SMN1; SMN2 (0.75) SMN1; SMN2TSHRTP53EGLN1EGLN3
Malic Acid SCHEMBL3061502 1.00 SMN1; SMN2 (0.75) SMN1; SMN2TSHRTP53EGLN1EGLN3
Malic Acid SCHEMBL1533801 1.00 SMN1; SMN2 (0.75) SMN1; SMN2TSHRTP53EGLN1EGLN3
Malic Acid SCHEMBL969854 0.98 SMN1; SMN2 (0.71) SMN1; SMN2TSHRTP53EGLN1EGLN3
Malic Acid SCHEMBL969848 0.98 SMN1; SMN2 (0.71) SMN1; SMN2TSHRTP53EGLN1EGLN3
Malic Acid SCHEMBL27560921 0.95 SMN1; SMN2 (0.68) SMN1; SMN2TSHRTP53EGLN1EGLN3
Malic Acid SCHEMBL465928 0.93 SMN1; SMN2 (0.65) SMN1; SMN2TSHRTP53EGLN1EGLN3
Malic Acid SCHEMBL465926 0.93 SMN1; SMN2 (0.65) SMN1; SMN2TSHRTP53EGLN1EGLN3

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
US-5171886-A Michael condensation of salts of maleic and malic acids in presence of calcium ion catalyst; reacting and reuse of by-products; hydration of sodium hydrogen maleate; detergent builders MONSANTO COMPANY (US) 1992-12-15 US disclosed