Hydrochloric Acid

Hydrochloric Acid

SCHEMBL29904696

C[n+]1ccn(CCO)c1.[Cl-].[Li]

nearest known ligand 0.57

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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 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
MEN1 O00255 1/20 0.52
APAF1 O14727 1/20 0.52
NPC1 O15118 1/20 0.52
PLA2G1B P04054 1/20 0.52
HSP90AA1 P07900 1/20 0.52
MAPT P10636 1/20 0.52
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
ATG4B Q9Y4P1 1/20 0.52
FDPS P14324 2/20 0.40
LMNA P02545 2/20 0.38
PON1 P27169 2/20 0.36
THRB P10828 1/20 0.30
HPGD P15428 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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 SCHEMBL1048130 0.98 SMN1; SMN2 (0.53) SMN1; SMN2MEN1APAF1NPC1PLA2G1B
SCHEMBL718979 0.96
SCHEMBL30070818 0.94 SMN1; SMN2 (0.53) SMN1; SMN2MEN1APAF1NPC1PLA2G1B
Iodide SCHEMBL2922211 0.94 SMN1; SMN2 (0.53) SMN1; SMN2MEN1APAF1NPC1PLA2G1B
Bromide SCHEMBL571801 0.94 SMN1; SMN2 (0.58) SMN1; SMN2MEN1APAF1NPC1PLA2G1B
SCHEMBL925726 0.88 SMN1; SMN2 (0.49) SMN1; SMN2MEN1APAF1NPC1PLA2G1B
SCHEMBL4264311 0.88 SMN1; SMN2 (0.49) SMN1; SMN2MEN1APAF1NPC1PLA2G1B
SCHEMBL3015802 0.88 SMN1; SMN2 (0.49) SMN1; SMN2MEN1APAF1NPC1PLA2G1B
Hydrochloric Acid SCHEMBL5950519 0.86 SMN1; SMN2 (0.59) SMN1; SMN2MEN1APAF1NPC1PLA2G1B
Glycolic Acid SCHEMBL2919958 0.85 SMN1; SMN2 (0.46) SMN1; SMN2MEN1APAF1NPC1PLA2G1B

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-2022210912-A1 AMMONIA PRODUCTION METHOD AND AMMONIA PRODUCTION APPARATUS 国立大学法人東京大学 2022-10-06 WO disclosed