Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8018852

CCCCn1cc[n+](C)c1.CCCn1cc[n+](C)c1.[Cl-].[Cl-]

nearest known ligand 0.89

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 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.73
HSP90AA1 P07900 2/20 0.73
KMT2A Q03164 2/20 0.73
SMN1; SMN2 Q16637 2/20 0.73
APAF1 O14727 1/20 0.73
NPC1 O15118 1/20 0.73
PLA2G1B P04054 1/20 0.73
MAPT P10636 1/20 0.73
MAPK1 P28482 1/20 0.73
HTT P42858 1/20 0.73
RAB9A P51151 1/20 0.73
NPSR1 Q6W5P4 1/20 0.73
ATG4B Q9Y4P1 1/20 0.73
FDPS P14324 15/20 0.39
PON1 P27169 1/20 0.38
TBXAS1 P24557 1/20 0.35

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 SCHEMBL36719 0.96 MEN1 (0.79) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Hydrochloric Acid SCHEMBL5317022 0.94 MEN1 (0.76) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Hydrochloric Acid SCHEMBL28926225 0.94 MEN1 (0.76) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Hydrochloric Acid SCHEMBL30502416 0.94 MEN1 (0.76) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Hydrochloric Acid SCHEMBL7266903 0.94 MEN1 (0.76) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL34969 0.94 MEN1 (0.81) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Bromide SCHEMBL28284894 0.92 SMN1; SMN2 (0.79) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Hydrochloric Acid SCHEMBL30662171 0.92 MEN1 (0.73) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL14841603 0.92 MEN1 (0.79) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Hydrochloric Acid SCHEMBL20957483 0.92 MEN1 (0.79) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1

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-2000040673-A1 INDUSTRIAL PROCESS AND CATALYSTS THE SECRETARY OF STATE FOR DEFENCE (GB) 2000-07-13 WO disclosed