Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2286648

Oc1ccc([S+](c2ccc(O)cc2)c2ccc(O)cc2)cc1.[Cl-]

nearest known ligand 0.53

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 0.40
ALOX15 P16050 3/20 0.53
CA3 P07451 3/20 0.53
CA14 Q9ULX7 3/20 0.53
HSD17B10 Q99714 3/20 0.53
MAPT P10636 3/20 0.53
ALDH1A1 P00352 2/20 0.53
CYP3A4 P08684 2/20 0.53
HIF1A Q16665 2/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
CA12 O43570 2/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA4 P22748 2/20 0.53
CA9 Q16790 2/20 0.53
LMNA P02545 2/20 0.53
HPGD P15428 2/20 0.53
KDM4E B2RXH2 1/20 0.53
NPC1 O15118 1/20 0.53

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
SCHEMBL501727 0.97 ALOX15 (0.57) ALOX15CA3CA14HSD17B10MAPT
Bromide SCHEMBL11133148 0.93 ALOX15 (0.53) ALOX15CA3CA14HSD17B10MAPT
Hydrochloric Acid SCHEMBL3142697 0.89 CA12 (0.50) ALOX15CA3CA14HSD17B10MAPT
SCHEMBL158163 0.85 CA12 (0.53) ALOX15CA3CA14HSD17B10MAPT
SCHEMBL502108 0.85 CA12 (0.53) ALOX15CA3CA14HSD17B10MAPT
SCHEMBL12639140 0.83 MAPK1 (0.50) ALOX15CA3CA14HSD17B10MAPT
SCHEMBL6117392 0.83 GAA (0.45) ALOX15CA3CA14HSD17B10MAPT
Water SCHEMBL548229 0.83 CA12 (0.50) ALOX15CA3CA14HSD17B10MAPT
SCHEMBL12770101 0.83 ACHE (0.68) ALOX15CA3CA14HSD17B10MAPT
SCHEMBL10022934 0.83 ACHE (0.68) ALOX15CA3CA14HSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4399233-A Process for preparing low molecular weight oxygenated compounds from syngas using novel catalyst system TEXACO INC. (US) 1983-08-16 US claimed
US-20140342291-A1 Novel Dual-Tone Resist Formulations And Methods BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2014-11-20 US disclosed
EP-2199856-B1 Cationic radiation curable compositions AGFA GRAPHICS NV (BE) 2013-08-07 EP disclosed
WO-2011133680-A2 NOVEL DUAL-TONE RESIST FORMULATIONS AND METHODS BOARD OF REGENTS THE UNIVERSITY OF TEXAS SYSTEM (US) 2011-10-27 WO disclosed
US-20110262860-A1 NOVEL DUAL-TONE RESIST FORMULATIONS AND METHODS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS 2011-10-27 US disclosed
US-20110195194-A1 CATIONIC RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2011-08-11 US disclosed
WO-2010069754-A1 CATIONIC RADIATION CURABLE COMPOSITIONS AGFA GRAPHICS NV (BE) 2010-06-24 WO disclosed
EP-2199856-A1 Cationic radiation curable compositions Agfa Graphics N.V. (BE) 2010-06-23 EP disclosed
EP-0410263-B1 Cationic photoinitiated polymerisation process and the preparation of relief motifs or photoimages using sulfonium salts BASF AG (DE) 1994-02-16 EP disclosed
US-5220037-A Photoinitiators for cationic polymerization BASF AKTIENGESELLSCHAFT (DE) 1993-06-15 US disclosed
US-5159088-A Photinitiators for cationic polymerization BASF AKTIENGESELLSCHAFT (DE) 1992-10-27 US disclosed
EP-0410263-A1 Cationic photoinitiated polymerisation process and the preparation of relief motifs or photoimages using sulfonium salts BASF Aktiengesellschaft (DE) 1991-01-30 EP disclosed
US-4399233-A Process for preparing low molecular weight oxygenated compounds from syngas using novel catalyst system TEXACO INC. (US) 1983-08-16 US disclosed
US-4391992-A N-Denitration of N,2,6-trinitroanilines with phase transfer catalysts AMERICAN CYANAMID COMPANY (US) 1983-07-05 US disclosed
US-4348319-A REACTION OF HALO-AZO DYE WITH COPPER CYANIDE IN WATER IN PRESENCE OF PHASE TRANSFER AGENT BAYER AKTIENGESELLSCHAFT (DE) 1982-09-07 US disclosed
EP-0049384-A1 N-denitration of N,2,6-trinitroanilines with phase transfer catalysts AMERICAN CYANAMID COMPANY (US) 1982-04-14 EP 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-20110195194-A1 CATIONIC RADIATION CURABLE COMPOSITIONS NR2E3, NR2E1, CCNE2 ACHE 4208/4885ALOX15 1334/4885CA3 1652/4885

“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.