Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8148702

CN(C)CCC1=C([Ti+2])CC=C1.[Cl-].[Cl-]

nearest known ligand 0.32

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 3)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.32
HRH3 Q9Y5N1 1/20 0.32
CHRNA7 P36544 1/20 0.31

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 SCHEMBL8448006 0.78
SCHEMBL8152932 0.76 TAAR1 (0.34) TAAR1HRH3
Hydrochloric Acid SCHEMBL3644219 0.74
Hydrochloric Acid SCHEMBL6332598 0.73
SCHEMBL7977764 0.73 TAAR1 (0.32) TAAR1HRH3CHRNA7
Hydrochloric Acid SCHEMBL4633244 0.73 TAAR1 (0.32) TAAR1HRH3
Hydrochloric Acid SCHEMBL8148699 0.73 TAAR1 (0.32) TAAR1HRH3
Hydrochloric Acid SCHEMBL6340287 0.73
Hydrochloric Acid SCHEMBL8453417 0.73
Hydrochloric Acid SCHEMBL6332811 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6117811-A CATALYSTS FOR POLYMERIZATION OF OLEFINS DSM N.V. (NL) 2000-09-12 US disclosed