Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3904152

Cn1c(-c2ccccc2)c(/N=N/c2sc(Br)c[n+]2C)c2ccccc21.[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
ALDH1A1 P00352 6/20 0.40
LMNA P02545 1/20 0.40
HSD17B10 Q99714 2/20 0.37
CYP2C19 P33261 1/20 0.37
MAPT P10636 5/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
HPGD P15428 2/20 0.36
HK1 P19367 1/20 0.35
HKDC1 Q2TB90 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
HTT P42858 1/20 0.34
ATM Q13315 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TEK Q02763 1/20 0.34
CYP11B2 P19099 2/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33

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 SCHEMBL3904156 1.00 ALDH1A1 (0.40) ALDH1A1LMNAHSD17B10CYP2C19MAPT
SCHEMBL3900604 0.99 ALDH1A1 (0.41) ALDH1A1LMNAHSD17B10CYP2C19MAPT
SCHEMBL3900602 0.99 ALDH1A1 (0.41) ALDH1A1LMNAHSD17B10CYP2C19MAPT
Bromide SCHEMBL3912216 0.98 ALDH1A1 (0.40) ALDH1A1LMNAHSD17B10CYP2C19MAPT
Bromide SCHEMBL3903486 0.98 ALDH1A1 (0.40) ALDH1A1LMNAHSD17B10CYP2C19MAPT
SCHEMBL3901547 0.90 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10CYP2C19MAPT
Hydrochloric Acid SCHEMBL3904895 0.87 ALDH1A1 (0.41) ALDH1A1LMNAHSD17B10CYP2C19MAPT
Hydrochloric Acid SCHEMBL3904898 0.87 ALDH1A1 (0.41) ALDH1A1LMNAHSD17B10CYP2C19MAPT
Hydrochloric Acid SCHEMBL3896062 0.87 IL1R1 (0.40) ALDH1A1MAPTNPC1RAB9AKDM4E
Hydrochloric Acid SCHEMBL3911568 0.87 ALDH1A1 (0.42) ALDH1A1MAPTNPC1RAB9AKDM4E

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
US-7517368-B2 Indolylthiazoliumazo dyes-containing colorants for keratin fibers WELLA AG (DE) 2009-04-14 US claimed
EP-1716209-B1 USE OF COMPOSITION CONTAINING INDOLYL THIAZOLIUM AZO DYES FOR DYING KERATIN FIBERS WELLA AG (DE) 2009-03-25 EP claimed
US-20080271264-A1 Indolylthiazoliumazo Dyes-Containing Colorants for Keratin Fibers Wella GmbH (DE) 2008-11-06 US claimed
US-7431741-B2 Brightening colorant with indolythiazolium dyes WELLA AG (DE) 2008-10-07 US claimed
US-20070180631-A1 Brightening colorant with indolythiazolium dyes Wella GmbH (DE) 2007-08-09 US claimed
EP-1730239-B1 LIGHTENING COLORANT CONTAINING INDOLYL THIAZOLIUM AZO DYES WELLA AG (DE) 2007-05-02 EP claimed
US-7517368-B2 Indolylthiazoliumazo dyes-containing colorants for keratin fibers WELLA AG (DE) 2009-04-14 US disclosed
US-20080271264-A1 Indolylthiazoliumazo Dyes-Containing Colorants for Keratin Fibers Wella GmbH (DE) 2008-11-06 US disclosed
US-7431741-B2 Brightening colorant with indolythiazolium dyes WELLA AG (DE) 2008-10-07 US disclosed
US-20070180631-A1 Brightening colorant with indolythiazolium dyes Wella GmbH (DE) 2007-08-09 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 (2 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-20070180631-A1 Brightening colorant with indolythiazolium dyes KRT18, TUBB1, IK ALDH1A1 89/4885LMNA 799/4885HSD17B10 1599/4885
US-20080271264-A1 Indolylthiazoliumazo Dyes-Containing Colorants for Keratin Fibers KRT18, IK, TUBA4A ALDH1A1 534/4885LMNA 190/4885HSD17B10 3433/4885

“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.