Malic Acid

Malic Acid

SCHEMBL28105083

O=C(O)CC(O)C(=O)O.O=C(O)CCC(=O)O.O=C(O)CCC(=O)O

nearest known ligand 0.83

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 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.83
TET2 Q6N021 6/20 0.59
KDM4A O75164 2/20 0.59
KDM4C Q9H3R0 2/20 0.59
KDM2A Q9Y2K7 2/20 0.59
TET3 O43151 2/20 0.59
LMNA P02545 3/20 0.50
ALKBH5 Q6P6C2 1/20 0.50
SUCNR1 Q9BXA5 1/20 0.50
EGLN1 Q9GZT9 1/20 0.50
TET1 Q8NFU7 1/20 0.48
FOLH1 Q04609 1/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
OR51E2 Q9H255 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
GABRR1 P24046 2/20 0.40
SLC15A2 Q16348 1/20 0.39

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 SCHEMBL4814892 1.00 SMN1; SMN2 (0.83) SMN1; SMN2TET2KDM4AKDM4CKDM2A
Malic Acid SCHEMBL11436449 0.97 SMN1; SMN2 (0.79) SMN1; SMN2TET2KDM4AKDM4CKDM2A
Cadaverine Tartrate SCHEMBL7419325 0.93 SMN1; SMN2 (0.71) SMN1; SMN2TET2KDM4AKDM4CKDM2A
Malic Acid SCHEMBL27589356 0.93 SMN1; SMN2 (0.71) SMN1; SMN2TET2KDM4AKDM4CKDM2A
Malic Acid SCHEMBL31673489 0.91
Malic Acid SCHEMBL14125844 0.91 SMN1; SMN2 (1.00) SMN1; SMN2TET2KDM4AKDM4CKDM2A
Malic Acid SCHEMBL98496 0.91
Malic Acid SCHEMBL856 0.91
Malic Acid SCHEMBL30036890 0.91
Malic Acid SCHEMBL89131 0.91 SMN1; SMN2 (1.00) SMN1; SMN2TET2KDM4AKDM4CKDM2A

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-106141502-A The light with special odour of soldering flux 西安鹭扬电子科技有限责任公司 2016-11-23 CN claimed