Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5907091

CCCCCCCCCCCC(=O)OCC[N+](C)(C)CCOC(=O)CCCCCCCCCCC.[Cl-]

nearest known ligand 0.69

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 3/20 0.51
▸ DGKA P23743 1/20 0.69
▸ DNM1 Q05193 1/20 0.57
▸ MAPT P10636 2/20 0.55
▸ BLM P54132 1/20 0.55
▸ RAD52 P43351 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ PAM P19021 2/20 0.53
▸ ADRA2A P08913 1/20 0.52
▸ ADRA1A P35348 1/20 0.52
▸ TSHR P16473 1/20 0.50
▸ PRSS1 P07477 1/20 0.50
▸ PRSS2 P07478 1/20 0.50
▸ PRSS3 P35030 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ NAAA Q02083 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.47
▸ DUSP3 P51452 1/20 0.47
▸ MEN1 O00255 1/20 0.47

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 SCHEMBL125089 1.00 DGKA (0.69) DGKADNM1MAPTBLMRAD52
Hydrochloric Acid SCHEMBL243866 1.00 DGKA (0.69) DGKADNM1MAPTBLMRAD52
SCHEMBL7113105 0.98 DGKA (0.71) DGKADNM1MAPTBLMRAD52
SCHEMBL1049974 0.98 DGKA (0.71) DGKADNM1MAPTBLMRAD52
SCHEMBL7113175 0.98 DGKA (0.71) DGKADNM1MAPTBLMRAD52
SCHEMBL7114491 0.98 DGKA (0.71) DGKADNM1MAPTBLMRAD52
SCHEMBL377473 0.98 DGKA (0.71) DGKADNM1MAPTBLMRAD52
SCHEMBL1052058 0.98 DGKA (0.71) DGKADNM1MAPTBLMRAD52
SCHEMBL1056065 0.98 DGKA (0.71) DGKADNM1MAPTBLMRAD52
Hydrochloric Acid SCHEMBL3462945 0.97 DGKA (0.65) DGKADNM1MAPTBLMRAD52

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-20060058216-A1 Concentrated, stable, preferably clear, fabric softening composition TRINH TOAN 2006-03-16 — — US disclosed
US-20060058215-A1 Concentrated, stable, preferably clear, fabric softening composition TRINH TOAN 2006-03-16 — — US disclosed
EP-1352948-A1 Concentrated, stable, fabric softening composition THE PROCTER & GAMBLE COMPANY (US) 2003-10-15 — — EP disclosed
US-20030153483-A1 Concentrated, stable fabric softening composition TRINH TOAN (US) 2003-08-14 — — US disclosed
US-6369025-B1 USEFUL FOR SOFTENING CLOTH THE PROCTER & GAMBLE COMPANY 2002-04-09 — — US disclosed
US-6323172-B1 AQUEOUS COMPOSITION COMPRISING FABRIC SOFTENER, SELECTED PRINCIPAL SOLVENT, LOW MOLECULAR WEIGHT WATER SOLUBLE SOLVENT TO IMPROVE CLARITY, WATER SOLUBLE CALCIUM AND/OR MAGNESIUM SALT THE PROCTER & GAMBLE COMPANY 2001-11-27 — — US disclosed
EP-0918842-A1 SUBSTANTIALLY ODOR-FREE POLYHYDROXYL SOLVENTS THE PROCTER & GAMBLE COMPANY (US) 1999-06-02 — — EP disclosed
EP-0839179-A1 CONCENTRATED, WATER DISPERSIBLE, STABLE, FABRIC SOFTENING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-05-06 — — EP disclosed
WO-1998002513-A1 SUBSTANTIALLY ODOR-FREE POLYHYDROXYL SOLVENTS THE PROCTER & GAMBLE COMPANY (US) 1998-01-22 — — WO disclosed
WO-1997003170-A1 CONCENTRATED, WATER DISPERSIBLE, STABLE, FABRIC SOFTENING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 — — WO disclosed
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