Lactic Acid

Lactic Acid

SCHEMBL7768064

CC(O)C(=O)O.CC(O)C(=O)O.CCCCCCCCCCCC(C)N(Cc1cccc(CN(C(C)CCCCCCCCCCC)C(C)CCCCCCCCCCC)c1)C(C)CCCCCCCCCCC

nearest known ligand 0.41

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 19)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.41
GPR84 Q9NQS5 3/20 0.41
FFAR1 O14842 1/20 0.41
CNR2 P34972 1/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
PPARG P37231 2/20 0.38
ALDH1A1 P00352 1/20 0.38
PPARA Q07869 1/20 0.38
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
GRIN3A Q8TCU5 1/20 0.37
PTGES O14684 1/20 0.37
ALOX5 P09917 1/20 0.37

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 SCHEMBL7764905 0.94 CSNK1E (0.40) CSNK1EGPR84FFAR1CNR2MEN1
Acetic Acid SCHEMBL7764388 0.92 CNR2 (0.42) CSNK1ECNR2MEN1KMT2APPARG
Succinic Acid SCHEMBL7764866 0.90 S1PR2 (0.41) FFAR1CNR2MEN1KMT2APPARG
Malonic Acid SCHEMBL7764459 0.90 CNR2 (0.43) CNR2MEN1KMT2APPARGPPARA
Lactic Acid SCHEMBL7768220 0.89 GPR84 (0.45) GPR84FFAR1ACE2
Adipic Acid SCHEMBL7760675 0.88 FFAR4 (0.47) GPR84FFAR1MEN1KMT2APPARG
Hydrochloric Acid SCHEMBL7766063 0.87 GRIN2D (0.43) CSNK1EGRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL7760756 0.87 GRIN2D (0.43) CSNK1EGRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL8722907 0.87 GRIN2D (0.43) CSNK1EGRIN2DGRIN3BGRIN1GRIN2A
Gluconic Acid SCHEMBL7763715 0.85 PDE4A (0.40) CSNK1EGPR84FFAR1CNR2PPARG

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