Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8743395

CC1=CC(C)C(COC(=O)C[N+](C)(C)C)CC1.[Cl-]

nearest known ligand 0.45

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 4)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.45
APOBEC3G Q9HC16 1/20 0.45
RAD52 P43351 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL8743418 0.82 APOBEC3A (0.37) APOBEC3AAPOBEC3G
SCHEMBL14993444 0.81 ALDH1A1 (0.35) APOBEC3AAPOBEC3G
SCHEMBL5930466 0.81 NLRP3 (0.40) APOBEC3AAPOBEC3G
SCHEMBL997368 0.80 NLRP3 (0.36) APOBEC3AAPOBEC3G
SCHEMBL14993011 0.72 CES2 (0.33) APOBEC3AAPOBEC3G
SCHEMBL2005575 0.71 ALDH1A1 (0.33) APOBEC3AAPOBEC3G
SCHEMBL295519 0.70 ALDH1A1 (0.36)
SCHEMBL14423794 0.70 ALDH1A1 (0.36)
Hydrochloric Acid SCHEMBL8743394 0.69 APOBEC3A (0.34) APOBEC3AAPOBEC3G
SCHEMBL22832664 0.69 ALDH1A1 (0.34) APOBEC3AAPOBEC3G

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
EP-0752465-A1 Betaine esters for delivery of alcohols THE PROCTER & GAMBLE COMPANY (US) 1997-01-08 EP disclosed