Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9480640

CC(C)CCC(=O)OCC[N+](C)(C)Cc1ccccc1.[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 20)

geneUniProtsupporting neighboursconfidence
CHRM2 known ✓ P08172 3/20 0.43
CHRM1 known ✓ P11229 3/20 0.43
CHRM3 known ✓ P20309 3/20 0.43
ACHE known ✓ P22303 2/20 0.40
SLC6A2 known ✓ P23975 1/20 0.40
SLC6A3 known ✓ Q01959 1/20 0.40
TDP1 Q9NUW8 2/20 0.45
CYP19A1 P11511 1/20 0.44
CHRM4 P08173 3/20 0.43
MAPT P10636 2/20 0.41
BLM P54132 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
TP53 P04637 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 3/20 0.40
TSHR P16473 2/20 0.40
LMNA P02545 2/20 0.40
ADRA2A P08913 2/20 0.40

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 SCHEMBL9663672 0.85 MEN1 (0.51) TDP1CHRM2CHRM4CHRM1CHRM3
SCHEMBL16353101 0.83 TDP1 (0.50) TDP1CHRM2CHRM4CHRM1CHRM3
SCHEMBL16353097 0.82 ALDH1A1 (0.54) TDP1CHRM2CHRM4CHRM1CHRM3
Hydrochloric Acid SCHEMBL7209575 0.81 MEN1 (0.61) TDP1CHRM2CHRM1CHRM3MEN1
Hydrochloric Acid SCHEMBL17024386 0.81 MEN1 (0.61) TDP1CHRM2CHRM1CHRM3MEN1
SCHEMBL9481799 0.80 MAPK1 (0.41) MAPTMEN1KMT2ASMN1; SMN2MAPK1
SCHEMBL17033274 0.79 DNM1 (0.60) TDP1CHRM2CHRM1CHRM3MEN1
SCHEMBL4956181 0.79 TDP1 (0.64) TDP1TP53SMN1; SMN2MAPK1TSHR
SCHEMBL9925312 0.77 MEN1 (0.47) TDP1CHRM2CHRM4CHRM1CHRM3
SCHEMBL16353094 0.77 ALDH1A1 (0.53) TDP1CHRM2CHRM4CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5194472-A Low fusion temperature, improved polyester compatibility; toners for copiers EASTMAN KODAK COMPANY (US) 1993-03-16 US disclosed
US-5110977-A Improved compatibility with polyester binder EASTMAN KODAK COMPANY (US) 1992-05-05 US disclosed
EP-0442105-A1 Electrostatographic toner particles containing monomeric ester-containing quaternary ammonium salt charge agents EASTMAN KODAK COMPANY (US) 1991-08-21 EP disclosed