Malic Acid

Malic Acid

SCHEMBL1131789

CCCCN(C(C)O)C(C)O.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 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ GPR84 Q9NQS5 7/20 0.43
▸ FFAR1 O14842 2/20 0.43
▸ LCK P06239 1/20 0.34
▸ PPARD Q03181 1/20 0.34
▸ ZDHHC20 Q5W0Z9 1/20 0.34
▸ ZDHHC2 Q9UIJ5 1/20 0.34
▸ TET2 Q6N021 3/20 0.33
▸ TET3 O43151 1/20 0.33
▸ TET1 Q8NFU7 1/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.33
▸ ACE2 Q9BYF1 1/20 0.33

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 SCHEMBL5874416 0.84 SMN1; SMN2 (0.58) SMN1; SMN2GPR84FFAR1TET2TET3
Malic Acid SCHEMBL5874426 0.84 SMN1; SMN2 (0.58) SMN1; SMN2GPR84FFAR1TET2TET3
Propionic Acid SCHEMBL1131224 0.83 FFAR3 (0.42) GPR84FFAR1PPARDFFAR4
Lactic Acid SCHEMBL1132261 0.83 TP53 (0.46) GPR84FFAR1LCKPPARDZDHHC20
Bicarbonate SCHEMBL1131248 0.83 CA12 (0.40) GPR84FFAR1LCKPPARDZDHHC20
Succinic Acid SCHEMBL1132247 0.82 AKR1B1 (0.46) GPR84FFAR1PPARDFFAR4
Glycolic Acid SCHEMBL1131482 0.82 GPR84 (0.37) GPR84FFAR1PPARDFFAR4
Cadaverine Tartrate SCHEMBL1131875 0.82 TSHR (0.40) GPR84FFAR1LCKPPARDZDHHC20
Oxalic Acid SCHEMBL1131169 0.81 CA12 (0.39) GPR84FFAR1LCKPPARDZDHHC20
Acetic Acid SCHEMBL1131177 0.81 CA12 (0.39) GPR84FFAR1LCKPPARDZDHHC20

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8784686-B2 Liquids INNOVIA FILMS LIMITED (GB) 2014-07-22 — — US claimed
EP-1805131-B1 IONIC LIQUIDS COMPRISING NITROGEN CONTAINING CATIONS INNOVIA FILMS LTD (GB) 2011-02-16 — — EP claimed
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 — — US claimed
US-9328220-B2 Liquids INNOVIA FILMS LIMITED (GB) 2016-05-03 — — US disclosed
US-8992798-B2 Liquids INNOVIA FILMS LIMITED (GB) 2015-03-31 — — US disclosed
US-8784686-B2 Liquids INNOVIA FILMS LIMITED (GB) 2014-07-22 — — US disclosed
US-20140187684-A1 LIQUIDS INNOVIA FILMS LIMITED (GB) 2014-07-03 — — US disclosed
US-20110257433-A1 LIQUIDS THE UNIVERSITY OF YORK (GB) 2011-10-20 — — US disclosed
EP-2322497-A1 Ionic liquids comprising nitrogen containing cations Innovia Films Limited (GB) 2011-05-18 — — EP disclosed
EP-1805131-B1 IONIC LIQUIDS COMPRISING NITROGEN CONTAINING CATIONS INNOVIA FILMS LTD (GB) 2011-02-16 — — EP disclosed
CN-101316810-A Ionic liquids BIONIQS LTD (GB) 2008-12-03 — — CN disclosed
US-20080221361-A1 Ionic Liquids BIONIQS LIMITED (GB) 2008-09-11 — — US disclosed
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 — — US disclosed
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