Malic Acid

Malic Acid

SCHEMBL2465724

Cc1ccc(C)cc1.O=C(O)CC(O)C(=O)O

nearest known ligand 0.65

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 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.65
FFAR1 O14842 2/20 0.45
KMO O15229 1/20 0.44
ACHE P22303 1/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 2/20 0.43
GAA P10253 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
STAT3 P40763 1/20 0.41

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 SCHEMBL27676626 0.86 SMN1; SMN2 (0.79) SMN1; SMN2KMOMAPT
SCHEMBL10777427 0.82 KMT2A (0.48) SMN1; SMN2FFAR1ACHEKMT2AALDH1A1
SCHEMBL10782076 0.82 ALDH1A1 (0.58) SMN1; SMN2KMOKMT2AALDH1A1LMNA
Malic Acid SCHEMBL27794963 0.81 SMN1; SMN2 (0.88) SMN1; SMN2KMO
Malic Acid SCHEMBL9782806 0.81 SMN1; SMN2 (0.88) SMN1; SMN2LMNAMAPT
Malic Acid SCHEMBL856 0.81
Malic Acid SCHEMBL98496 0.81
Malic Acid SCHEMBL14125844 0.81 SMN1; SMN2 (1.00) SMN1; SMN2KMOLMNA
Malic Acid SCHEMBL31673494 0.81
Malic Acid SCHEMBL31673489 0.81

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-8025840-B2 Compositions and methods for inhibiting corrosion in aqueous media GENERAL ELECTRIC COMPANY (US) 2011-09-27 US claimed