Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4199343

CCCCCCCCC=CCCCCCCCC(=O)c1ccc[n+](C)c1C(=O)CCCCCCCC=CCCCCCCCC.[Cl-]

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

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

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 12/20 0.52
CES1 P23141 5/20 0.47
SOAT2 O75908 1/20 0.46
SOAT1 P35610 1/20 0.46
DAGLA Q9Y4D2 2/20 0.46
DUSP3 P51452 1/20 0.44
PTPN7 P35236 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL20339307 0.99 FAAH (0.50) FAAHCES1SOAT2SOAT1DAGLA
Hydrochloric Acid SCHEMBL19691934 0.81 FAAH (0.53) FAAHCES1SOAT2SOAT1DAGLA
SCHEMBL27861997 0.77 HTT (0.56) FAAHCES1SOAT2SOAT1DAGLA
SCHEMBL28341165 0.77 SOAT2 (0.55) FAAHCES1SOAT2SOAT1DAGLA
SCHEMBL9602533 0.77 HTT (0.56) FAAHCES1SOAT2SOAT1DAGLA
SCHEMBL25383771 0.76 FAAH (0.57) FAAHCES1SOAT2SOAT1DAGLA
SCHEMBL27502912 0.76 SOAT2 (0.53) FAAHCES1SOAT2SOAT1DAGLA
SCHEMBL7170901 0.76 SOAT1 (0.53) FAAHCES1SOAT2SOAT1DAGLA
SCHEMBL2856074 0.76 SOAT2 (0.53) FAAHCES1SOAT2SOAT1DAGLA
SCHEMBL28430631 0.75 SOAT2 (0.52) FAAHCES1SOAT2SOAT1DAGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1408932-A4 PARTICLES WITH IMPROVED SOLUBILIZATION CAPACITY LYOTROPIC THERAPEUTICS INC (US) 2009-02-25 EP disclosed
EP-1408932-A1 PARTICLES WITH IMPROVED SOLUBILIZATION CAPACITY Lyotropic Therapeutics, LLC (US) 2004-04-21 EP disclosed
WO-2003000236-A1 PARTICLES WITH IMPROVED SOLUBILIZATION CAPACITY LYOTROPIC THERAPEUTICS, INC (US) 2003-01-03 WO disclosed