Lactic Acid

Lactic Acid

SCHEMBL7768220

CC(O)C(=O)O.CC(O)C(=O)O.CCCCCCCCCCCC(C)N(Cc1ccc(CN(C(C)CCCCCCCCCCC)C(C)CCCCCCCCCCC)cc1)C(C)CCCCCCCCCCC

nearest known ligand 0.45

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 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 6/20 0.45
FFAR1 O14842 1/20 0.45
S1PR2 O95136 2/20 0.42
S1PR1 P21453 2/20 0.42
S1PR4 O95977 1/20 0.42
S1PR3 Q99500 1/20 0.42
ACE2 Q9BYF1 1/20 0.41
MAPT P10636 1/20 0.40
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
SPHK1 Q9NYA1 4/20 0.39

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 SCHEMBL7764537 0.93 GPR84 (0.44) GPR84FFAR1S1PR2S1PR1S1PR4
Acetic Acid SCHEMBL7764900 0.91 THRA (0.42) GPR84FFAR1S1PR2S1PR1S1PR3
Lactic Acid SCHEMBL7768064 0.89 CSNK1E (0.41) GPR84FFAR1ACE2
Succinic Acid SCHEMBL7768273 0.88 S1PR1 (0.48) GPR84FFAR1S1PR2S1PR1S1PR3
Malonic Acid SCHEMBL7765984 0.88 S1PR1 (0.43) GPR84S1PR2S1PR1S1PR4S1PR3
Adipic Acid SCHEMBL7764425 0.87 FFAR4 (0.51) GPR84FFAR1S1PR2S1PR1S1PR3
Hydrochloric Acid SCHEMBL7764492 0.86 THRA (0.37) MAPTTHRATHRBLCK
Hydrochloric Acid SCHEMBL7760906 0.86 THRA (0.37) MAPTTHRATHRBLCK
Hydrochloric Acid SCHEMBL8720967 0.86 THRA (0.37) MAPTTHRATHRBLCK
Hydrochloric Acid SCHEMBL8719708 0.86 THRA (0.37) MAPTTHRATHRBLCK

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