Hydrochloric Acid

Hydrochloric Acid

SCHEMBL395682

C1=CC([Ti+2]C2C=Cc3ccccc32)c2ccccc21.[Cl-].[Cl-]

nearest known ligand 0.39

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
CHRM2 known ✓ P08172 1/20 0.32
CHRM1 known ✓ P11229 1/20 0.32
CHRM3 known ✓ P20309 1/20 0.32
SLC6A2 known ✓ P23975 1/20 0.32
SLC6A3 known ✓ Q01959 1/20 0.32
HTR2A P28223 2/20 0.39
HTR6 P50406 1/20 0.38
SIGMAR1 Q99720 4/20 0.32
KDM4E B2RXH2 2/20 0.32
CYP2D6 P10635 2/20 0.32
BRD4 O60885 1/20 0.32
CCL2 P13500 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
DRD2 P14416 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
NFKB1 P19838 1/20 0.32
HTR2C P28335 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 SCHEMBL29574289 1.00 HTR2A (0.39) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Hydrochloric Acid SCHEMBL3670932 0.98 HTR2A (0.38) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Ethylene SCHEMBL4978169 0.96 HTR2A (0.36) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Fluoride Ion SCHEMBL7637223 0.95 HTR2A (0.39) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Bromide SCHEMBL5368508 0.95 HTR2A (0.43) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Bromide SCHEMBL31427621 0.95 HTR2A (0.43) HTR2AHTR6SIGMAR1KDM4ECYP2D6
SCHEMBL4576586 0.95 HTR2A (0.39) HTR2AHTR6SIGMAR1KDM4ECYP2D6
SCHEMBL7032645 0.91 HTR2A (0.36) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Hydrochloric Acid SCHEMBL7644480 0.90 HTR6 (0.33) HTR2AHTR6SIGMAR1
Hydrochloric Acid SCHEMBL30449732 0.86 HTR6 (0.33) HTR2AHTR6

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 331 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7186782-B2 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2007-03-06 US claimed
US-20060041079-A1 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION 2006-02-23 US claimed
US-6982236-B2 Process to polymerize olefins UNIVATION TECHNOLOGIES, LLC (US) 2006-01-03 US claimed
US-6897273-B2 Catalyst composition, method of polymerization and polymer therefrom UNIVATION TECHNOLOGIES, LLC (US) 2005-05-24 US claimed
US-6881797-B2 Process for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2005-04-19 US claimed
US-20040082727-A1 Process for hydrogenation of conjugated diene polymer TSRC CORPORATION (CN) 2004-04-29 US claimed
US-6656866-B2 Metallocene and non-metallocene, homogeneous catalysts, particularly for use in the economical gas and slurry phase processes; spray dried olefin polymerization catalysts UNIVATION TECHNOLOGIES, LLC 2003-12-02 US claimed
US-20030207762-A9 CATALYST PREPARATION METHOD UNIVATION TECHNOLOGIES, LLC 2003-11-06 US claimed
US-20020119890-A1 Catalyst preparation method WENZEL TIMOTHY T (US) 2002-08-29 US claimed
US-20020103310-A1 Catalyst composition, method of polymerization and polymer therefrom UNIVATION TECHNOLOGIES, LLC 2002-08-01 US claimed
US-6143844-A POLYMERIZING 1-OLEFINS BY CONTACING SLURRY OR GAS PHASE IN REACTORS WITH HETEROGENOUS CATALYST MADE BY CHEMISORBING IN A REACTION CHAMBER VAPORIZED METALLOCENE ONTO AN INORGANIC SUPPORT AND REMOVING UNREACTED METALLOCENE BOREALIS A/S (DK) 2000-11-07 US claimed
EP-0731729-B1 METHOD FOR PREPARING A CATALYST FOR OLEFIN POLYMERIZATION BOREALIS AS (DK) 2000-03-01 EP claimed
US-5925717-A SELECTIVE HYDROGENATION OF POLYMERS WITH TITANIUM CATALYSTS WITH INDENE COMPOUND LIGANDS SHELL OIL COMPANY (US) 1999-07-20 US claimed
US-5767032-A TREATING A SOLID INORGANIC SUPPORT WITH A VAPORIZED METALLOCENE; COORDINATION CATALYSTS; REGULATION OF CATALYST ACTIVITY TO REGULATE POLYMER MOLECULAR WEIGHT AND MOLECULAR WEIGHT DISTRIBUTION BOREALIS A/S (DK) 1998-06-16 US claimed
EP-0795564-A1 Process for hydrogenation of conjugated diene polymers and catalyst compositions suitable for use therein SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1997-09-17 EP claimed
EP-0731729-A1 CATALYST FOR OLEFIN POLYMERIZATION AND A METHOD FOR THE MANUFACTURE THEREOF BOREALIS A/S (DK) 1996-09-18 EP claimed
WO-1995015216-A1 CATALYST FOR OLEFIN POLYMERIZATION AND A METHOD FOR THE MANUFACTURE THEREOF BOREALIS A/S (DK) 1995-06-08 WO claimed
EP-0412750-B1 Production of alpha-olefin polymers MITSUBISHI PETROCHEMICAL CO (JP) 1995-02-15 EP claimed
US-5104838-A Titanium-containing solid catalyst component MITSUBISHI PETROCHEMICAL COMPANY LIMITED (JP) 1992-04-14 US claimed
EP-0412750-A2 Production of alpha-olefin polymers MITSUBISHI CHEMICAL CORPORATION (JP) 1991-02-13 EP claimed