Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4655654

CN(C)c1ccc(C(=C2C=CC(=[N+](C)C)C=C2)c2ccco2)cc1.[Cl-]

nearest known ligand 0.72

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 1/20 0.72
CHRM1 known ✓ P11229 1/20 0.72
CHRM3 known ✓ P20309 1/20 0.72
ACHE known ✓ P22303 1/20 0.72
SLC6A2 known ✓ P23975 1/20 0.72
SLC6A3 known ✓ Q01959 1/20 0.72
MAPT P10636 8/20 0.72
TDP1 Q9NUW8 5/20 0.72
MEN1 O00255 5/20 0.72
KMT2A Q03164 5/20 0.72
SMN1; SMN2 Q16637 5/20 0.72
THRB P10828 4/20 0.72
MAPK1 P28482 4/20 0.72
HIF1A Q16665 3/20 0.72
HTT P42858 3/20 0.72
TP53 P04637 3/20 0.72
CYP3A4 P08684 3/20 0.72
ALOX12 P18054 2/20 0.72
RECQL P46063 2/20 0.72
BLM P54132 2/20 0.72

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
SCHEMBL4656427 0.99 MAPT (0.69) MAPTTDP1MEN1KMT2ASMN1; SMN2
Bromide SCHEMBL4655670 0.97 MAPT (0.68) MAPTTDP1MEN1KMT2ASMN1; SMN2
Perchlorate SCHEMBL4656868 0.94 MAPT (0.63) MAPTTDP1MEN1KMT2ASMN1; SMN2
Hexamethyl Pararosaniline SCHEMBL9171 0.85 TDP1 (1.00) MAPTTDP1MEN1KMT2ASMN1; SMN2
Hexamethyl Pararosaniline SCHEMBL94116 0.83 TDP1 (0.96) MAPTTDP1MEN1KMT2ASMN1; SMN2
Brilliant Green SCHEMBL28216 0.82 TDP1 (0.88) MAPTTDP1MEN1KMT2ASMN1; SMN2
Brilliant Green SCHEMBL171205 0.81 TDP1 (0.84) MAPTTDP1MEN1KMT2ASMN1; SMN2
SCHEMBL4655638 0.78 MAPT (0.85) MAPTTDP1MEN1KMT2ASMN1; SMN2
SCHEMBL14310873 0.78 TDP1 (0.84) MAPTTDP1MEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL2053249 0.77 TDP1 (0.82) MAPTTDP1MEN1KMT2ASMN1; SMN2

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-1435227-B1 Composition for the dyeing of keratinous fibres comprising a direct dye of the monoheteroyldiarylmethane type or a leuco precursor thereof and a dyeing process using it OREAL (FR) 2008-12-03 EP claimed
US-7211117-B2 Composition for dyeing keratin fibers comprising at least one dye chosen from monoheteroyldiarylmethane direct dyes and the leuco precursors thereof and dyeing method using it L'OREAL S.A. (FR) 2007-05-01 US claimed
US-20040216247-A1 Composition for dyeing keratin fibers comprising at least one dye chosen from monoheteroyldiarylmethane direct dyes and the leuco precursors thereof and dyeing method using it L'OREAL S.A. (FR) 2004-11-04 US claimed
US-20040216247-A1 Composition for dyeing keratin fibers comprising at least one dye chosen from monoheteroyldiarylmethane direct dyes and the leuco precursors thereof and dyeing method using it L'OREAL S.A. (FR) 2004-11-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040216247-A1 Composition for dyeing keratin fibers comprising at least one dye chosen from monoheteroyldiarylmethane direct dyes and the leuco precursors thereof and dyeing method using it KRT18, KMO, PLOD3 CHRM2 3658/4885CHRM1 3720/4885CHRM3 3047/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.