Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9757097

CCCCCCCCCCCCCC[N+](C)(C)CCN1CCCCC1=O.[Cl-]

nearest known ligand 0.43

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 8)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.43
DNM1 Q05193 6/20 0.42
GAA P10253 1/20 0.38
PLA2G1B P04054 1/20 0.38
HSP90AA1 P07900 1/20 0.38
RAD52 P43351 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
KMT2A Q03164 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
SCHEMBL9549209 0.93 HTT (0.44) HTTDNM1GAAKMT2A
SCHEMBL23001106 0.88 HTT (0.46) HTTDNM1KMT2A
SCHEMBL10575712 0.85 HTT (0.41) HTTDNM1GAAPLA2G1BHSP90AA1
SCHEMBL10528405 0.85 ALDH1A1 (0.40) HTTDNM1GAAKMT2A
SCHEMBL9548987 0.84 GAA (0.38) HTTGAAKMT2A
Hydrochloric Acid SCHEMBL9549118 0.82 HTT (0.41) HTTDNM1GAAPLA2G1BHSP90AA1
Hydrochloric Acid SCHEMBL9549172 0.82 HTT (0.41) HTTDNM1GAAPLA2G1BHSP90AA1
Hydrochloric Acid SCHEMBL9549535 0.82 HTT (0.41) HTTDNM1GAAPLA2G1BHSP90AA1
Hydrochloric Acid SCHEMBL9549295 0.82 HTT (0.41) HTTDNM1GAAPLA2G1BHSP90AA1
Hydrochloric Acid SCHEMBL9549087 0.82 HTT (0.41) HTTDNM1GAAPLA2G1BHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0287649-A4 COMPOSITIONS USED IN PERMANENT STRUCTURE ALTERING OF HAIR 1991-08-21 EP disclosed
US-4871535-A PERMANENT WAVES GAF CORPORATION (US) 1989-10-03 US disclosed
EP-0287649-A1 COMPOSITIONS USED IN PERMANENT STRUCTURE ALTERING OF HAIR GAF CHEMICALS CORPORATION (US) 1988-10-26 EP disclosed
WO-1988002997-A1 COMPOSITIONS USED IN PERMANENT STRUCTURE ALTERING OF HAIR GAF CORPORATION (US) 1988-05-05 WO disclosed