Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9170205

Cc1cc(CC2=CC=CC2)c(C)c2c1-c1ccccc1C2.[Cl-].[Cl-].[Zr+2]

nearest known ligand 0.31

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
MAP3K9 P80192 1/20 0.31
MAP3K11 Q16584 1/20 0.31
PNMT P11086 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 SCHEMBL9170496 0.85 PNMT (0.35) MAP3K9MAP3K11PNMT
Hydrochloric Acid SCHEMBL9166997 0.81 PNMT (0.38) MAP3K9MAP3K11PNMT
Hydrochloric Acid SCHEMBL7604670 0.81 PNMT (0.37) MAP3K9MAP3K11PNMT
Hydrochloric Acid SCHEMBL9170485 0.81 PNMT (0.35) MAP3K9MAP3K11PNMT
Hydrochloric Acid SCHEMBL5348858 0.77 PNMT (0.51) PNMT
SCHEMBL7607098 0.76 PNMT (0.38) MAP3K9MAP3K11PNMT
Hydrochloric Acid SCHEMBL9163302 0.75 MAP3K9 (0.33) MAP3K9MAP3K11PNMT
Hydrochloric Acid SCHEMBL9163450 0.75
Hydrochloric Acid SCHEMBL5346821 0.75 PNMT (0.51) PNMT
Hydrochloric Acid SCHEMBL5347439 0.75 PNMT (0.51) PNMT

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-5420320-A Method for preparing cyclopentadienyl-type ligands and metallocene compounds PHILLIPS PETROLEUM COMPANY (US) 1995-05-30 US disclosed