Hydrochloric Acid

Hydrochloric Acid

SCHEMBL217523

CC1=C2CCC3=C(C)C([Zr+2]C1c1cccc(-c4ccccc4)c12)c1cccc(-c2ccccc2)c13.[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 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.36
HTR7 P34969 5/20 0.36
DRD2 P14416 1/20 0.36
CHRNB2 P17787 1/20 0.33
CHRNA4 P43681 1/20 0.33
HTR2B P41595 3/20 0.33
TMEM97 Q5BJF2 3/20 0.33
SIGMAR1 Q99720 2/20 0.33
CYP11B2 P19099 3/20 0.32
BRD4 O60885 1/20 0.32
CYP17A1 P05093 1/20 0.32
CYP19A1 P11511 1/20 0.32
CYP11B1 P15538 1/20 0.32
PARP10 Q53GL7 1/20 0.32
PARP11 Q9NR21 1/20 0.32
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
ADRA2A P08913 3/20 0.31
ADRA2B P18089 2/20 0.31
ADRA2C P18825 2/20 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 SCHEMBL218744 0.91 HTR1A (0.34) HTR1AHTR7DRD2CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL6047511 0.83 HTR1A (0.31) HTR1AHTR7DRD2HTR2BTMEM97
Hydrochloric Acid SCHEMBL2567611 0.80 MEN1 (0.33) HTR1ADRD2HTR2B
Hydrochloric Acid SCHEMBL217236 0.79 PARP10 (0.35) HTR1AHTR7DRD2CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL5616232 0.79 HTR1A (0.34) HTR1AHTR7DRD2CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL218728 0.79 ADRA2C (0.36) CYP11B2CYP17A1CYP19A1CYP11B1ADRA2C
Hydrochloric Acid SCHEMBL6464432 0.78 PDCD1 (0.31) HTR1AHTR7DRD2CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL8158431 0.78 PDCD1 (0.31) HTR1AHTR7DRD2CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL481289 0.78 PDCD1 (0.31) HTR1AHTR7DRD2CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL8151555 0.78 PDCD1 (0.34) HTR1AHTR7DRD2CHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088867-B2 Multiple catalyst system for olefin polymerization and polymers produced therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-01-03 US claimed
US-8361579-B2 Coloured pipes for transporting disinfectant-containing water TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2013-01-29 US disclosed
EP-1558655-B1 MULTIPLE CATALYST SYSTEM FOR OLEFIN POLYMERIZATION AND POLYMERS PRODUCED THEREFROM EXXONMOBIL CHEM PATENTS INC (US) 2012-08-29 EP disclosed
US-8088867-B2 Multiple catalyst system for olefin polymerization and polymers produced therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-01-03 US disclosed
EP-2203508-B1 COLOURED PIPES FOR TRANSPORTING DISINFECTANT-CONTAINING WATER TOTAL PETROCHEMICALS RES FELUY (BE) 2011-03-16 EP disclosed
US-20110033648-A1 Coloured Pipes for Transporting Disinfectant-Containing Water TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2011-02-10 US disclosed
US-7662895-B2 comprising polypropylene which is produced in presence of a metallocene transition metal catalyst and an activator; peak melting point temperature below about 110 degrees C., a tensile set of 40% or less, and greater than or equal to about 60% [r]dyads EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-02-16 US disclosed
EP-2053084-A1 Coloured pipes for transporting disinfectant-containing water. TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2009-04-29 EP disclosed
EP-1954724-A1 SYNDIOTACTIC PROPYLENE ELASTOMERS ExxonMobil Chemical Patents Inc. (US) 2008-08-13 EP disclosed
WO-2007061525-A1 SYNDIOTACTIC PROPYLENE ELASTOMERS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-05-31 WO disclosed
US-20070117941-A1 Syndiotactic propylene elastomers EXXONMOBIL CHEMICAL PATENTS INC. 2007-05-24 US disclosed
EP-1016689-B1 Olefin thermoplastic elastomer compositions MITSUI CHEMICALS INC (JP) 2007-03-07 EP disclosed
EP-1753796-A1 MULTIPLE CATALYST AND REACTOR SYSTEM FOR OLEFIN POLYMERIZATION AND POLYMERS PRODUCED THEREFROM ExxonMobil Chemical Patents, Inc., A Corporation of the State of Delaware (US) 2007-02-21 EP disclosed
WO-2005113622-A1 MULTIPLE CATALYST AND REACTOR SYSTEM FOR OLEFIN POLYMERIZATION AND POLYMERS PRODUCED THEREFROM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-12-01 WO disclosed
EP-1558655-A2 MULTIPLE CATALYST SYSTEM FOR OLEFIN POLYMERIZATION AND POLYMERS PRODUCED THEREFROM Exxonmobil Chemical Patents Inc. (US) 2005-08-03 EP disclosed
WO-2004046214-A2 MULTIPLE CATALYST SYSTEM FOR OLEFIN POLYMERIZATION AND POLYMERS PRODUCED THEREFROM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-06-03 WO disclosed
US-6713562-B2 MOLDABILITY AND CAPABLE OF PROVIDING MOLDINGS HAVING PLIABILITY MITSUI CHEMICALS, INC. (JP) 2004-03-30 US disclosed
US-20030022999-A1 Resin compositions and use of the same KAGAMI MAMORU (JP) 2003-01-30 US disclosed