Malic Acid

Malic Acid

SCHEMBL1131786

CCCCN(CCO)CCO.CCCCN(CCO)CCO.O=C(O)CC(O)C(=O)O

nearest known ligand 0.50

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 15)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ GPR84 Q9NQS5 7/20 0.42
▸ FFAR1 O14842 1/20 0.42
▸ KDM5A P29375 4/20 0.41
▸ PHF8 Q9UPP1 2/20 0.39
▸ KDM4C Q9H3R0 2/20 0.39
▸ CA12 O43570 2/20 0.35
▸ CA1 P00915 2/20 0.35
▸ CA9 Q16790 2/20 0.35
▸ ICMT O60725 1/20 0.33
▸ ALB P02768 1/20 0.33
▸ OR51E2 Q9H255 1/20 0.33
▸ TET2 Q6N021 3/20 0.32
▸ TET3 O43151 1/20 0.32
▸ TET1 Q8NFU7 1/20 0.32

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 SCHEMBL5874426 0.93 SMN1; SMN2 (0.58) SMN1; SMN2GPR84FFAR1KDM5APHF8
Malic Acid SCHEMBL5874416 0.93 SMN1; SMN2 (0.58) SMN1; SMN2GPR84FFAR1KDM5APHF8
Trolamine SCHEMBL5874557 0.88 SMN1; SMN2 (0.65) SMN1; SMN2KDM4COR51E2TET2TET3
Cadaverine Tartrate SCHEMBL1131873 0.82 KDM5A (0.41) GPR84FFAR1KDM5APHF8KDM4C
Lactic Acid SCHEMBL1132260 0.82 TP53 (0.42) GPR84FFAR1KDM5APHF8KDM4C
Cadaverine Tartrate SCHEMBL1132209 0.82 KDM5A (0.41) GPR84FFAR1KDM5APHF8KDM4C
Malic Acid SCHEMBL5875321 0.82 SMN1; SMN2 (0.62) SMN1; SMN2GPR84FFAR1KDM4COR51E2
Malic Acid SCHEMBL5875327 0.82 SMN1; SMN2 (0.62) SMN1; SMN2GPR84FFAR1KDM4COR51E2
Glycolic Acid SCHEMBL1131480 0.80 KDM5A (0.49) GPR84FFAR1KDM5APHF8KDM4C
Propionic Acid SCHEMBL1131223 0.80 KDM5A (0.49) GPR84FFAR1KDM5APHF8KDM4C

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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