Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4656499

CN(C)c1ccc(C(=C2C=CC(=[N+](C)C)C=C2)c2ccccn2)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
MEN1 O00255 6/20 0.72
KMT2A Q03164 6/20 0.72
MAPK1 P28482 5/20 0.72
TDP1 Q9NUW8 5/20 0.72
THRB P10828 4/20 0.72
HTT P42858 4/20 0.72
TP53 P04637 4/20 0.72
SMN1; SMN2 Q16637 4/20 0.72
MAPT P10636 4/20 0.72
HIF1A Q16665 3/20 0.72
CYP3A4 P08684 3/20 0.72
SNCA P37840 3/20 0.72
ALOX12 P18054 2/20 0.72
RECQL P46063 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
SCHEMBL4656550 1.00 MEN1 (0.72) MEN1KMT2AMAPK1TDP1THRB
Brilliant Green SCHEMBL28216 0.85 TDP1 (0.88) MEN1KMT2AMAPK1TDP1THRB
Hexamethyl Pararosaniline SCHEMBL9171 0.85 TDP1 (1.00) MEN1KMT2AMAPK1TDP1THRB
Brilliant Green SCHEMBL171205 0.83 TDP1 (0.84) MEN1KMT2AMAPK1TDP1THRB
Hexamethyl Pararosaniline SCHEMBL94116 0.83 TDP1 (0.96) MEN1KMT2AMAPK1TDP1THRB
SCHEMBL4655638 0.81 MAPT (0.85) MEN1KMT2AMAPK1TDP1THRB
SCHEMBL4657906 0.79 MAPK1 (0.63) MEN1KMT2AMAPK1TDP1THRB
SCHEMBL4655651 0.78 KMT2A (0.74) MEN1KMT2AMAPK1TDP1THRB
SCHEMBL14310873 0.78 TDP1 (0.84) MEN1KMT2AMAPK1TDP1THRB
Hydrochloric Acid SCHEMBL30368330 0.77 TDP1 (0.72) MEN1KMT2AMAPK1TDP1THRB

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 5 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-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 disclosed
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.