Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4659079

CCC1=Cc2c(-c3c4ccccc4cc4ccccc34)cccc2C1[Zr+2](C1C(CC)=Cc2c(-c3c4ccccc4cc4ccccc34)cccc21)=[Si](C)C.[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
HTR1A P08908 1/20 0.32
HTR7 P34969 1/20 0.32
CES1 P23141 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
Hydrochloric Acid SCHEMBL7189349 0.91 HTR1A (0.31) HTR1AHTR7CES1
Hydrochloric Acid SCHEMBL4659330 0.89 CNR1 (0.30)
Hydrochloric Acid SCHEMBL4659223 0.89
Hydrochloric Acid SCHEMBL4658320 0.89 ALDH1A1 (0.32)
Hydrochloric Acid SCHEMBL4659173 0.88 HSD11B1 (0.30)
Hydrochloric Acid SCHEMBL4658313 0.88 HTR1A (0.30) HTR1AHTR7
Hydrochloric Acid SCHEMBL4659189 0.88 HTR1A (0.30) HTR1AHTR7
Hydrochloric Acid SCHEMBL31126400 0.87 SLC6A4 (0.32) HTR7
Hydrochloric Acid SCHEMBL6903687 0.87 SLC6A4 (0.32) HTR7
Hydrochloric Acid SCHEMBL3807132 0.85 CES1 (0.33) HTR1AHTR7CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1088836-B1 ETHYLENE/ALPHA-OLEFIN/UNCONJUGATED POLYENE COPOLYMER RUBBER, RUBBER COMPOSITION FOR SEALING, MOLDED RUBBER FOR SEALING, AND PROCESS FOR PRODUCING THE MOLDED RUBBER PART MITSUI CHEMICALS INC (JP) 2012-11-21 EP disclosed
EP-1640415-B1 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS INC (JP) 2008-12-17 EP disclosed
EP-1065241-B1 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS INC (JP) 2006-04-05 EP disclosed
EP-1640415-A2 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS, INC. (JP) 2006-03-29 EP disclosed
US-6833045-B1 Solid particles of graft modified ethylene/ alpha -olefin copolymer dispersed in solvent; adhesive for packaging; coatings, primers MITSUI CHEMICALS, INC. (JP) 2004-12-21 US disclosed
US-6635727-B1 Random copolymer comprising structural units derived from comonomers of ethylene, one or more alpha-olefins, one or more trienes, and one or more non-conjugated polyenes in specified amounts and having specified intrinsic viscosity MITSUI CHEMICALS, INC. (JP) 2003-10-21 US disclosed
US-6635705-B2 Crosslinked crystalline polyolefin resin, an ethylene-alpha-olefin-non-conjugated polyene copolymer rubber, and polyisobutylene, butyl rubber or a propylene-ethylene copolymer MITSUI CHEMICALS, INC. (JP) 2003-10-21 US disclosed
US-6410650-B1 MOLDING MATERIALS MITSUI CHEMICALS INC (JP) 2002-06-25 US disclosed
US-20020055591-A1 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS, INC. 2002-05-09 US disclosed
EP-1152016-A1 ETHYLENE COPOLYMER RUBBER, PROCESS FOR PRODUCING THE SAME, AND USE Mitsui Chemicals, Inc. (JP) 2001-11-07 EP disclosed
EP-1088836-A1 ETHYLENE/ALPHA-OLEFIN/UNCONJUGATED POLYENE COPOLYMER RUBBER, RUBBER COMPOSITION FOR SEALING, MOLDED RUBBER FOR SEALING, AND PROCESS FOR PRODUCING THE MOLDED RUBBER Mitsui Chemicals, Inc. (JP) 2001-04-04 EP disclosed
EP-1065241-A2 Olefinic thermoplastic elastomer composition and method for producing the same Mitsui Chemicals, Inc. (JP) 2001-01-03 EP disclosed