Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7744956

CC(CC1CO1)[N+](C)(C)[N+](C)(C)[N+](C)(C)C.[Cl-].[Cl-].[Cl-]

nearest known ligand 0.31

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 7)

geneUniProtsupporting neighboursconfidence
CHRM2 known ✓ P08172 3/20 0.31
CHRM1 known ✓ P11229 3/20 0.31
CHRM3 known ✓ P20309 2/20 0.31
CHRM5 P08912 3/20 0.31
CHRM4 P08173 2/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31

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
Hydrochloric Acid SCHEMBL28022294 0.73 CHRM2 (0.31) CHRM2CHRM5CHRM1CHRM4CHRM3
Hydrochloric Acid SCHEMBL28201730 0.71
SCHEMBL13773198 0.65
SCHEMBL13773188 0.65
SCHEMBL51487 0.65
SCHEMBL27533253 0.65 ALDH1A1 (0.38) CHRM2CHRM5CHRM1CHRM4CHRM3
SCHEMBL25443757 0.63 ALDH1A1 (0.36) CHRM2CHRM5CHRM1CHRM4CHRM3
SCHEMBL27441234 0.63
Hydrochloric Acid SCHEMBL11164328 0.63
SCHEMBL4270564 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001002527-A1 DETERGENT COMPOSITIONS OR COMPONENTS THE PROCTER & GAMBLE COMPANY (US) 2001-01-11 WO disclosed