Hydrochloric Acid

Hydrochloric Acid

SCHEMBL11061516

CCCCCCCC/C=C\CCCCCCCCNCCN1CC[N+](CCO)=C1CCCCCCCCCCCC.[Cl-]

nearest known ligand 0.36

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 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.32
CNR1 P21554 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
CNR2 P34972 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
ALOX12 P18054 1/20 0.32
BLM P54132 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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 SCHEMBL142027 0.90 MGLL (0.34)
Hydrochloric Acid SCHEMBL23142695 0.90 MGLL (0.34)
SCHEMBL141305 0.89 MGLL (0.35)
SCHEMBL9314254 0.85 MGLL (0.34)
Hydrochloric Acid SCHEMBL11253281 0.82 EEF2K (0.37) ALDH1A1MEN1KMT2A
Sulfuric Acid SCHEMBL4376501 0.80 EPHX2 (0.35) EPHX2
SCHEMBL16887389 0.80 MGLL (0.35)
Hydrochloric Acid SCHEMBL4074680 0.79 MGLL (0.46) EPHX2CNR1ALDH1A1CNR2MAPT
Hydrochloric Acid SCHEMBL421819 0.79 MGLL (0.46) EPHX2CNR1ALDH1A1CNR2MAPT
Hydrochloric Acid SCHEMBL5147519 0.79 ALDH1A1 (0.31) CNR1ALDH1A1CNR2

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-0043622-B1 FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1984-11-21 EP disclosed