Hydrochloric Acid

Hydrochloric Acid

SCHEMBL219041

CC1=C(c2cccc3ccccc23)c2c3cccc2C1[Zr+2]C1C(C)=C(c2cccc4ccccc24)c2c(cccc21)C3.[Cl-].[Cl-]

nearest known ligand 0.34

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
SLC6A3 known ✓ Q01959 2/20 0.33
SLC6A2 known ✓ P23975 1/20 0.32
HTR7 P34969 3/20 0.34
HTR1A P08908 2/20 0.34
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
DHFR P00374 1/20 0.33
SLC6A4 P31645 2/20 0.32
CYP2D6 P10635 1/20 0.32
GSK3B P49841 1/20 0.32
ADK P55263 1/20 0.32
NISCH Q9Y2I1 1/20 0.31
KDM1A O60341 1/20 0.31
MTNR1A P48039 2/20 0.31
MTNR1B P49286 1/20 0.31
BRD4 O60885 1/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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 SCHEMBL218908 0.92 HTR7 (0.36) HTR7HTR1ASLC6A3CNR1CNR2
Hydrochloric Acid SCHEMBL14775250 0.84 SLC6A2 (0.34) SLC6A3SLC6A4CYP2D6SLC6A2
Hydrochloric Acid SCHEMBL216589 0.82 HTR7 (0.34) HTR7HTR1ASLC6A3CNR1CNR2
Hydrochloric Acid SCHEMBL8158808 0.81 HTR1A (0.35) HTR7HTR1A
Hydrochloric Acid SCHEMBL7586032 0.81 DHFR (0.32) CNR1CNR2DHFRGSK3BADK
Hydrochloric Acid SCHEMBL969634 0.81 DHFR (0.32) CNR1CNR2DHFRGSK3BADK
Hydrochloric Acid SCHEMBL7930461 0.78 CHRNA1 (0.32) SLC6A3DHFRSLC6A4SLC6A2GSK3B
Hydrochloric Acid SCHEMBL5616484 0.74 HTR7 (0.36) HTR7HTR1ASLC6A3CNR1CNR2
Hydrochloric Acid SCHEMBL218124 0.74 HTR7 (0.36) HTR7HTR1ASLC6A3CNR1CNR2
Hydrochloric Acid SCHEMBL5343314 0.74 HTR2A (0.33) HTR1AMAPTALDH1A1

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-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
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-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-7223822-B2 Multiple catalyst and reactor system for olefin polymerization and polymers produced therefrom EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-05-29 US disclosed
US-20070117941-A1 Syndiotactic propylene elastomers EXXONMOBIL CHEMICAL PATENTS INC. 2007-05-24 US 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
EP-1153938-A1 CATALYST FOR STEREOREGULAR POLYMERIZATION OF ALPHA-OLEFIN AND PROCESS FOR PRODUCING STEREOREGULAR ALPHA-OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-11-14 EP disclosed