Malic Acid

Malic Acid

SCHEMBL11772086

CCCCCCCCCCCCCCCCN(C)C.O=C(O)CC(O)C(=O)O

nearest known ligand 0.52

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 10)

geneUniProtsupporting neighboursconfidence
▸ DNM1 Q05193 5/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ GPR84 Q9NQS5 7/20 0.52
▸ FFAR1 O14842 1/20 0.52
▸ KDM4A O75164 5/20 0.40
▸ KDM4C Q9H3R0 5/20 0.40
▸ KDM5A P29375 1/20 0.40
▸ KDM7A Q6ZMT4 1/20 0.40
▸ PHF8 Q9UPP1 1/20 0.40
▸ KDM2A Q9Y2K7 1/20 0.40

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 SCHEMBL11772074 1.00 DNM1 (0.52) DNM1SMN1; SMN2GPR84FFAR1KDM4A
Malic Acid SCHEMBL1888155 0.88 GPR84 (0.44) DNM1SMN1; SMN2GPR84FFAR1
Behenic Acid SCHEMBL7783098 0.85 GPR84 (0.46) GPR84FFAR1
Malic Acid SCHEMBL27655462 0.85 SMN1; SMN2 (0.60) SMN1; SMN2GPR84FFAR1KDM4AKDM4C
Malic Acid SCHEMBL27783805 0.84 GPR84 (0.46) SMN1; SMN2GPR84FFAR1KDM4CKDM5A
Malic Acid SCHEMBL4851298 0.83 DNM1 (0.72) DNM1
Behenic Acid SCHEMBL7783097 0.82 GPR84 (0.46) GPR84FFAR1
Lactic Acid SCHEMBL23174633 0.82 DNM1 (0.60) DNM1GPR84FFAR1
Lactic Acid SCHEMBL29600390 0.82 DNM1 (0.60) DNM1GPR84FFAR1
Lactic Acid SCHEMBL5934076 0.82 DNM1 (0.60) DNM1GPR84FFAR1

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-3954846-A New quaternary ammonium salts of malic acid and their application in cosmetics AGENCE NATIONALE DE VALORIZATION DE LA RECHERCHE (ANVAR) (FR) 1976-05-04 — — US disclosed
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