Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9575650

CCCCCCCC/C=C\CCCCCCCCC(C)[N+](C)(O)O.[Cl-]

nearest known ligand 0.46

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
CHRM1 known ✓ P11229 1/20 0.42
SLC6A2 known ✓ P23975 1/20 0.42
FAAH O00519 4/20 0.42
TRPV1 Q8NER1 1/20 0.42
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
TERT O14746 3/20 0.42
PTPN1 P18031 3/20 0.42
PPARG P37231 3/20 0.42
PPARD Q03181 3/20 0.42
PPARA Q07869 3/20 0.42
CYP1A2 P05177 2/20 0.42
MAPT P10636 2/20 0.42
CYP2C19 P33261 2/20 0.42
BLM P54132 2/20 0.42
HSD17B10 Q99714 2/20 0.42
FABP4 P15090 2/20 0.42
KMT2A Q03164 2/20 0.42
GMNN O75496 1/20 0.42
USP2 O75604 1/20 0.42

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
SCHEMBL9575939 0.98 FAAH (0.44) FAAHTRPV1FFAR1FFAR4TERT
Formic Acid SCHEMBL9794876 0.90 FAAH (0.46) FAAHTRPV1FFAR1FFAR4TERT
Hydrochloric Acid SCHEMBL10713120 0.89 FAAH (0.42) FAAHTRPV1FFAR1FFAR4TERT
Hydrochloric Acid SCHEMBL11330087 0.89 SPHK1 (0.43) FFAR1MAPTLMNAMMP2TP53
Hydrochloric Acid SCHEMBL9575630 0.89 SPHK1 (0.43) FFAR1MAPTLMNAMMP2TP53
Hydrochloric Acid SCHEMBL10663599 0.89 SPHK1 (0.43) FFAR1MAPTLMNAMMP2TP53
Hydrochloric Acid SCHEMBL9575611 0.87 FAAH (0.44) FAAHTRPV1TERTPTPN1PPARG
SCHEMBL9575956 0.87 SPHK1 (0.45) FFAR1PPARDMAPTLMNAMMP2
Glycolic Acid SCHEMBL9794795 0.86 FABP3 (0.51) FAAHFFAR1FFAR4CYP1A2MAPT
Succinic Acid SCHEMBL9575747 0.86 FABP3 (0.59) FAAHTERTCYP1A2MAPTCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0371406-B1 OXYALKYLATED QUATERNARY AMMONIUM COMPOUNDS, PROCESSES FOR PRODUCTION THEREOF, AND PLANT GROWTH REGULATING COMPOSITIONS CONTAINING SAID COMPOUNDS DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1993-08-04 EP disclosed
US-5076828-A Immersing seeds into quaternary solution prior to planting DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1991-12-31 US disclosed
EP-0371406-A1 Oxyalkylated quaternary ammonium compounds, processes for production thereof, and plant growth regulating compositions containing said compounds DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) 1990-06-06 EP disclosed