Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7646508

CCC1=CC(C)=CC1.[Cl-].[Cl-].[Zr+2]c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.40

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 7)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.40
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
DRD2 P14416 1/20 0.34
DRD4 P21917 1/20 0.34
DRD3 P35462 1/20 0.34
PGR P06401 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 SCHEMBL540483 0.78 PNMT (0.52) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL29556732 0.78 PNMT (0.52) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL7946952 0.76 PNMT (0.51) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL5358644 0.76 PNMT (0.48) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL27342827 0.75 PNMT (0.50) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL7937688 0.74 PNMT (0.52) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL9861299 0.74 PNMT (0.38) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL7638494 0.73 PNMT (0.48) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL5087314 0.71 PNMT (0.38) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL5718325 0.71 NPC1 (0.40) PNMTNPC1RAB9ADRD2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6403734-B1 POLYMERIZING ALPHA-OLEFIN BY CONTACTING WITH CATALYST SYSTEM COMPRISING BRIDGED FLUORENYL METALLOCENE CONTAINING METAL OF GROUP 4 OR 5 AND SUITABLE COCATALYST PHILLIPS PETROLEUM COMPANY 2002-06-11 US disclosed
EP-0666267-B1 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 2001-04-18 EP disclosed
US-6162936-A Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 2000-12-19 US disclosed
EP-0666267-A2 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1995-08-09 EP disclosed
US-5436305-A Preparing polymer catalysts by reaction of alkali metal alkyl and fluorenyl in solvent PHILLIPS PETROLEUM COMPANY (US) 1995-07-25 US disclosed
EP-0524624-A2 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1993-01-27 EP disclosed