Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1435652

CN(C)c1ccc(/N=N/c2cc[n+](C)cc2)cc1.[Cl-]

nearest known ligand 0.59

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
ALDH1A1 P00352 6/20 0.59
MAPK1 P28482 4/20 0.59
HSD17B10 Q99714 4/20 0.59
TSHR P16473 4/20 0.59
TDP1 Q9NUW8 3/20 0.59
KMT2A Q03164 7/20 0.52
MEN1 O00255 6/20 0.52
MAPT P10636 3/20 0.52
ALPG P10696 2/20 0.52
THRB P10828 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
LMNA P02545 1/20 0.52
HTT P42858 1/20 0.52
GFER P55789 1/20 0.52
NPC1 O15118 6/20 0.50
RAB9A P51151 5/20 0.50
POLB P06746 2/20 0.50
KDM4E B2RXH2 2/20 0.50
MAOA P21397 1/20 0.50

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 SCHEMBL1435655 1.00 ALDH1A1 (0.59) ALDH1A1MAPK1HSD17B10TSHRTDP1
SCHEMBL25664229 0.98 ALDH1A1 (0.61) ALDH1A1MAPK1HSD17B10TSHRTDP1
SCHEMBL7050647 0.98 ALDH1A1 (0.61) ALDH1A1MAPK1HSD17B10TSHRTDP1
SCHEMBL1405466 0.82 ALDH1A1 (0.81) ALDH1A1MAPK1HSD17B10TSHRTDP1
SCHEMBL3217836 0.82 ALDH1A1 (0.81) ALDH1A1MAPK1HSD17B10TSHRTDP1
SCHEMBL3217829 0.82 ALDH1A1 (0.81) ALDH1A1MAPK1HSD17B10TSHRTDP1
SCHEMBL3217840 0.82 ALDH1A1 (0.81) ALDH1A1MAPK1HSD17B10TSHRTDP1
SCHEMBL1405467 0.82 ALDH1A1 (0.81) ALDH1A1MAPK1HSD17B10TSHRTDP1
Hydrochloric Acid SCHEMBL3748847 0.80 ALDH1A1 (0.59) ALDH1A1MAPK1HSD17B10TSHRTDP1
SCHEMBL1435234 0.80 ALDH1A1 (0.59) ALDH1A1MAPK1HSD17B10TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1844109-B1 USE OF CATIONIC AZACYANINE DYES FOR COLORING KERATIN FIBERS PROCTER & GAMBLE (US) 2011-03-30 EP disclosed
US-7517367-B2 Cationic naphthyldiazo dyes and keratin fibers-coloring agents containing these dyes WELLA AG (DE) 2009-04-14 US disclosed
US-7455698-B2 Cationic dyes and dyestuff for keratin fibres containing said compounds WELLA AG (DE) 2008-11-25 US disclosed
US-7413578-B2 Symmetric and assymetric dyes with a mesomeric structure, e.g., 2-[(1-ethyl-4(1H)-quinolinylidene)amino]-6-methoxy-3-methyl-1,3-benzothiazol-3-ium tetrafluoroborate; may be used to dye predamaged sections of hair without oxidizing agent neat or mixed with an acidic, neutral or basic aqueous diluent THE PROCTER & GAMBLE COMPANY (US) 2008-08-19 US disclosed
US-7410507-B2 Use of cationic azacyanine dyes for coloring keratin fibers THE PROCTER & GAMBLE COMPANY (US) 2008-08-12 US disclosed
US-20080167453-A1 Cationic Naphthyldiazo Dyes and Keratin Fibers-Coloring Agents Containing These Dyes WELLA AG (DE) 2008-07-10 US disclosed
US-20070258929-A1 Cationic Dyes and Dyestuff for Keratin Fibres Containing Said Compounds HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2007-11-08 US disclosed
US-20070022545-A1 Use of cationic azacyanine dyes for coloring keratin fibers PROCTER & GAMBLE COMPANY, THE 2007-02-01 US disclosed
US-20070000071-A1 Colorants comprising cationic azacyanine dyes PROCTER & GAMBLE COMPANY, THE 2007-01-04 US disclosed
US-20040034945-A1 Lightening dye with direct-dyeing colorants WELLA AKTIENGESELLSCHAFT (DE) 2004-02-26 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-20080167453-A1 Cationic Naphthyldiazo Dyes and Keratin Fibers-Coloring Agents Containing These Dyes KRT18, KPNB1, KPNA3 ALDH1A1 1280/4885MAPK1 935/4885HSD17B10 3536/4885
US-20070022545-A1 Use of cationic azacyanine dyes for coloring keratin fibers KRT18, AZI2, MKI67 ALDH1A1 391/4885MAPK1 882/4885HSD17B10 1928/4885
US-20070258929-A1 Cationic Dyes and Dyestuff for Keratin Fibres Containing Said Compounds KRT18, IK, S100A4 ALDH1A1 666/4885MAPK1 1178/4885HSD17B10 2135/4885
US-20040034945-A1 Lightening dye with direct-dyeing colorants KRT18, TUBB1, TUBA1C ALDH1A1 37/4885MAPK1 207/4885HSD17B10 991/4885
US-20070000071-A1 Colorants comprising cationic azacyanine dyes KRT18, IK, NUP205 ALDH1A1 1520/4885MAPK1 1181/4885HSD17B10 3791/4885

“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.