Lactic Acid

Lactic Acid

SCHEMBL7768244

CC(O)C(=O)O.CC(O)C(=O)O.CCCCCCCCCCCC(C)N(Cc1ccccc1CN(C(C)CCCCCCCCCCC)C(C)CCCCCCCCCCC)C(C)CCCCCCCCCCC

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CHRM1DRD2DRD3DRD4HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR2APDE3ASIGMAR1

The experimentally established mechanism targets of Lactic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.43
GPR84 Q9NQS5 3/20 0.42
FFAR1 O14842 1/20 0.42
ALDH1A1 P00352 2/20 0.42
CYSLTR2 Q9NS75 2/20 0.41
CYSLTR1 Q9Y271 2/20 0.41
ACE2 Q9BYF1 1/20 0.40
ASAH1 Q13510 2/20 0.39
ACER2 Q5QJU3 1/20 0.39
NAAA Q02083 2/20 0.39
CNR2 P34972 1/20 0.39
MAPT P10636 1/20 0.38
LCK P06239 1/20 0.38
PPARD Q03181 1/20 0.38
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
MMP1 P03956 1/20 0.38
MMP3 P08254 1/20 0.38

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
Cadaverine Tartrate SCHEMBL7764354 0.93 CSNK1E (0.42) CSNK1EGPR84FFAR1ALDH1A1CYSLTR2
Acetic Acid SCHEMBL7764520 0.92 ALDH1A1 (0.44) CSNK1EALDH1A1CYSLTR2CYSLTR1CNR2
Succinic Acid SCHEMBL7764851 0.89 CYSLTR2 (0.50) FFAR1ALDH1A1CYSLTR2CYSLTR1
Malonic Acid SCHEMBL7763542 0.89 CYSLTR2 (0.44) CSNK1EALDH1A1CYSLTR2CYSLTR1ASAH1
Adipic Acid SCHEMBL7765945 0.88 CYSLTR2 (0.52) GPR84FFAR1ALDH1A1CYSLTR2CYSLTR1
Hydrochloric Acid SCHEMBL7760971 0.87 CSNK1E (0.40) CSNK1EALDH1A1CYSLTR2CYSLTR1
Hydrochloric Acid SCHEMBL7764448 0.87 CSNK1E (0.40) CSNK1EALDH1A1CYSLTR2CYSLTR1
Hydrochloric Acid SCHEMBL8720793 0.87 CSNK1E (0.40) CSNK1EALDH1A1CYSLTR2CYSLTR1
Sulfuric Acid SCHEMBL7765900 0.86 TP53 (0.44) CSNK1EALDH1A1CYSLTR2CYSLTR1
Lactic Acid SCHEMBL7768220 0.86 GPR84 (0.45) GPR84FFAR1ACE2MAPTLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0825175-B1 Quaternary ammonium disinfectant NICCA CHEMICAL CO (JP) 2001-06-13 EP disclosed
EP-0825175-A1 Quaternary ammonium disinfectant NICCA CHEMICAL CO., LTD. (JP) 1998-02-25 EP disclosed