Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7943281

COCC1=CCC([Zr+2](=C(c2ccccc2)c2ccccc2)c2cccc3c2Cc2ccccc2-3)=C1.[Cl-].[Cl-]

nearest known ligand 0.33

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 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 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 SCHEMBL7101775 0.89 PNMT (0.33) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL7945483 0.87 PNMT (0.32) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL7942051 0.86 PNMT (0.32) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL7104531 0.85 PNMT (0.33) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL1235559 0.85 NPC1 (0.34) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL7934594 0.85 PNMT (0.31) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL7108286 0.84 PNMT (0.32) PNMT
Hydrochloric Acid SCHEMBL7945478 0.81 NPC1 (0.32) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL674164 0.81 NPC1 (0.32) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL7107213 0.81 NPC1 (0.32) 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
US-6316558-B1 POLYMERIZING OLEFIN USING CATALYST COMPRISING TRANSITION METAL COMPOUND, COMPOUND CAPABLE OF A REACTING WITH TRANSITION METAL COMPOUND TO FORM A CATIONIC TRANSITION METAL COMPOUND, ORGANOMETALLIC TO FORM POLYOLEFIN TOSOH CORPORATION (JP) 2001-11-13 US disclosed
EP-0786466-A1 Transition metal compound, olefin polymerization catalyst comprising the compound, and process for production of olefin polymer Tosoh Corporation (JP) 1997-07-30 EP disclosed