Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7753033

CCCCC1=C([Hf+2]c2cccc3c2Cc2ccccc2-3)CC=C1.[Cl-].[Cl-]

nearest known ligand 0.36

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
PNMT P11086 1/20 0.35
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
Iodide SCHEMBL7935539 0.91 PNMT (0.36) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL4890082 0.79 PNMT (0.37) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL7752720 0.75 PNMT (0.35) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL1115874 0.75 PNMT (0.35) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL45368 0.74
Hydrochloric Acid SCHEMBL27432298 0.73 MEN1 (0.30)
Hydrochloric Acid SCHEMBL5486364 0.72
Hydrochloric Acid SCHEMBL29695725 0.72 PNMT (0.50) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL816978 0.72 PNMT (0.50) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL715049 0.72 NPC1 (0.34) PNMTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1071690-A1 METALLOCENE PURIFICATION PROCESS ALBEMARLE CORPORATION (US) 2001-01-31 EP disclosed
WO-1999052919-A1 METALLOCENE PURIFICATION PROCESS ALBEMARLE CORPORATION (US) 1999-10-21 WO disclosed