Hydrochloric Acid

Hydrochloric Acid

SCHEMBL338804

COc1ccc(N=Nc2n(C)cc[n+]2C)cc1.[Cl-]

nearest known ligand 0.40

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
ACHE known ✓ P22303 1/20 0.34
MAPT P10636 8/20 0.40
RAB9A P51151 6/20 0.40
MAPK1 P28482 4/20 0.40
NPC1 O15118 4/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
KDM4E B2RXH2 3/20 0.40
PKM P14618 1/20 0.40
PTGS2 P35354 1/20 0.40
HSP90AA1 P07900 1/20 0.36
OPRK1 P41145 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 1/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.35
GFER P55789 1/20 0.35

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 SCHEMBL338803 1.00 MAPT (0.40) MAPTRAB9AMAPK1NPC1MEN1
SCHEMBL1131569 0.98 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1
SCHEMBL20323029 0.98 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1
SCHEMBL1131570 0.98 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1
Iodide SCHEMBL18063119 0.97 MAPT (0.40) MAPTRAB9AMAPK1NPC1MEN1
Iodide SCHEMBL18063120 0.97 MAPT (0.40) MAPTRAB9AMAPK1NPC1MEN1
Perchlorate SCHEMBL5860330 0.93 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1
SCHEMBL6308285 0.93 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1
SCHEMBL6308287 0.93 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1
Perchlorate SCHEMBL5860332 0.93 MAPT (0.41) MAPTRAB9AMAPK1NPC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3271423-B1 CATIONIC DIRECT DYES BASF SE (DE) 2022-08-31 EP disclosed
US-20180244924-A1 Cationic Direct Dyes BASF SE (DE) 2018-08-30 US disclosed
EP-3271423-A1 CATIONIC DIRECT DYES BASF SE (DE) 2018-01-24 EP disclosed
WO-2016146813-A1 CATIONIC DIRECT DYES BASF SE (DE) 2016-09-22 WO disclosed
US-8097044-B2 Hair compositions comprising at least one disulfide direct dye and at least one alkaline hydroxide agent and simultaneous hair shaping and dyeing processes L'OREAL S.A. (FR) 2012-01-17 US disclosed
EP-2044158-B1 POLYMERIC HAIR DYES BASF SE (DE) 2011-11-23 EP disclosed
EP-2259766-A2 COMPOSITION FOR DYEING KERATIN FIBRES COMPRISING AT LEAST ONE DIRECT DYE COMPRISING A DISULPHIDE/PROTECTED-THIOL FUNCTION AND AT LEAST ONE SILICEOUS COMPOUND COMPRISING A THIOL FUNCTION AND METHOD USING THE COMPOSITION L'Oréal (FR) 2010-12-15 EP disclosed
US-7731761-B2 Polymeric hair dyes CIBA CORPORATION (US) 2010-06-08 US disclosed
US-20090255063-A1 Polymeric hair dyes CIBA CORP. 2009-10-15 US disclosed
WO-2009109457-A2 COMPOSITION FOR DYEING KERATIN FIBRES COMPRISING AT LEAST ONE DIRECT DYE COMPRISING A DISULPHIDE/PROTECTED-THIOL FUNCTION AND AT LEAST ONE SILICEOUS COMPOUND COMPRISING A THIOL FUNCTION AND METHOD USING THE COMPOSITION L'OREAL (FR) 2009-09-11 WO disclosed
US-7582122-B2 Mixed cationic dyes comprising at least one anthraquinone chromophore and their use in methods of hair dyeing L'OREAL S.A. (FR) 2009-09-01 US disclosed
EP-2082728-A2 Use of cationic polymeric hair dye Beiersdorf AG (DE) 2009-07-29 EP disclosed
US-20090126755-A1 Hair compositions comprising at least one disulfide direct dye and at least one alkaline hydroxide agent and simultaneous hair shaping an dyeing processes L'OREAL S.A. (FR) 2009-05-21 US disclosed
EP-2044158-A1 POLYMERIC HAIR DYES Ciba Holding Inc. (CH) 2009-04-08 EP disclosed
US-7488354-B2 Dyeing composition comprising at least one disulphide dye and method of dyeing human keratin fibers using this dye L'OREAL S.A. (FR) 2009-02-10 US disclosed
WO-2008009579-A1 POLYMERIC HAIR DYES CIBA HOLDING INC. (CH) 2008-01-24 WO disclosed
US-7282068-B2 Polycationic azo compounds for dyeing keratin fibers, dye composition containing the same, and methods for making such compounds L'OREAL S.A. (FR) 2007-10-16 US disclosed
US-20070125261-A1 Mixed cationic dyes comprising at least one anthraquinone chromophore and their use in methods of hair dyeing L'OREAL S.A. (FR) 2007-06-07 US disclosed
US-20060080791-A1 Dyeing composition comprising at least one disulphide dye and method of dyeing human keratin fibers using this dye L'OREAL S.A. (FR) 2006-04-20 US disclosed
US-20060021160-A1 Polycationic azo compounds for dyeing keratin fibers, dye compositions containing the same, and methods for making such compounds L'OREAL 2006-02-02 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 (5 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-20090126755-A1 Hair compositions comprising at least one disulfide direct dye and at least one alkaline hydroxide agent and simultaneous hair shaping an dyeing processes KRT18, DSG1, ALPG ACHE 1410/4885MAPT 960/4885RAB9A 4038/4885
US-20060080791-A1 Dyeing composition comprising at least one disulphide dye and method of dyeing human keratin fibers using this dye KRT18, DSG1, DSC1 ACHE 4075/4885MAPT 1075/4885RAB9A 4066/4885
US-20060021160-A1 Polycationic azo compounds for dyeing keratin fibers, dye compositions containing the same, and methods for making such compounds KRT18, CYBA, JUP ACHE 4124/4885MAPT 1664/4885RAB9A 4619/4885
US-20180244924-A1 Cationic Direct Dyes H1-0, TPH1, H1-2 ACHE 2316/4885MAPT 3520/4885RAB9A 3559/4885
US-20090255063-A1 Polymeric hair dyes SCO2, CYB5R3, OR10J3 ACHE 4319/4885MAPT 3761/4885RAB9A 4419/4885

“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.