Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1809875

CCCCCCCCCCCCCCCCOC(C[N+](C)(C)C)C[N+](C)(C)C.[Cl-].[Cl-]

nearest known ligand 0.65

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
DNM1 Q05193 2/20 0.53
PRKD3 O94806 3/20 0.47
PRKCG P05129 3/20 0.47
PRKCB P05771 3/20 0.47
PRKCA P17252 3/20 0.47
PRKCH P24723 3/20 0.47
PRKCI P41743 3/20 0.47
PRKCE Q02156 3/20 0.47
PRKCQ Q04759 3/20 0.47
PRKCZ Q05513 3/20 0.47
PRKCD Q05655 3/20 0.47
PRKD1 Q15139 3/20 0.47
NPSR1 Q6W5P4 4/20 0.45
MAPK1 P28482 4/20 0.45
GMNN O75496 3/20 0.45
LMNA P02545 3/20 0.45
MAPT P10636 3/20 0.45
MEN1 O00255 2/20 0.45
HSP90AA1 P07900 2/20 0.45
BLM P54132 2/20 0.45

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 SCHEMBL1819724 1.00 DNM1 (0.53) DNM1PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL1772881 0.89 PRKD3 (0.54) DNM1PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL1773674 0.89 PRKD3 (0.54) DNM1PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL9808836 0.89 PRKD3 (0.54) DNM1PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL7720158 0.89 PRKD3 (0.54) DNM1PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL7718400 0.89 PRKD3 (0.54) DNM1PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL9808821 0.89 PRKD3 (0.54) DNM1PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL1773357 0.89 PRKD3 (0.54) DNM1PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL7720123 0.89 PRKD3 (0.54) DNM1PRKD3PRKCGPRKCBPRKCA
SCHEMBL29105923 0.88 DNM1 (0.50) DNM1PRKD3PRKCGPRKCBPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2496552-B1 DIFUNCTIONAL, AMINE-BASED SURFACTANTS, AND THEIR PRECURSORS, PREPARATION, COMPOSITIONS AND USE DOW GLOBAL TECHNOLOGIES LLC (US) 2016-07-13 EP disclosed
EP-2496552-A1 DIFUNCTIONAL, AMINE-BASED SURFACTANTS, AND THEIR PRECURSORS, PREPARATION, COMPOSITIONS AND USE Dow Global Technologies LLC (US) 2012-09-12 EP disclosed
WO-2011056620-A1 DIFUNCTIONAL, AMINE-BASED SURFACTANTS, AND THEIR PRECURSORS, PREPARATION, COMPOSITIONS AND USE DOW GLOBAL TECHNOLOGIES INC. (US) 2011-05-12 WO disclosed
US-20110112328-A1 Difunctional, Amine-Based Surfactants, and Their Precursors, Preparation, Compositions and Use DOW GLOBAL TECHNOLOGIES LLC 2011-05-12 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-20110112328-A1 Difunctional, Amine-Based Surfactants, and Their Precursors, Preparation, Compositions and Use C1S, DEGS1, F12 DNM1 627/4885PRKD3 1987/4885PRKCG 3304/4885

“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.