Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3385863

[Cl-].[Cl-].[Cl-].[Ti+3]C1c2ccccc2-c2ccccc21

nearest known ligand 0.52

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
ACHE known ✓ P22303 3/20 0.41
CHRM2 known ✓ P08172 1/20 0.41
CHRM1 known ✓ P11229 1/20 0.41
SLC6A2 known ✓ P23975 1/20 0.41
SLC6A3 known ✓ Q01959 1/20 0.41
GPR3 P46089 3/20 0.46
HTR2A P28223 2/20 0.46
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
DRD1 P21728 1/20 0.41
SLC6A4 P31645 1/20 0.41
ADRA1A P35348 1/20 0.41
OPRM1 P35372 1/20 0.41
DRD3 P35462 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
CYP19A1 P11511 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC8 Q9BY41 1/20 0.39

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
Iodide SCHEMBL3382484 0.94 GPR3 (0.46) GPR3HTR2AACHECHRM2HTR1A
Fluoride Ion SCHEMBL3384407 0.94 GPR3 (0.46) GPR3HTR2AACHECHRM2HTR1A
Bromide SCHEMBL3383748 0.94 GPR3 (0.46) GPR3HTR2AACHECHRM2HTR1A
SCHEMBL8774247 0.86 GPR3 (0.46) GPR3HTR2AACHECHRM2HTR1A
Hydrochloric Acid SCHEMBL8159748 0.85 GPR3 (0.41) GPR3HTR2AACHECHRM2HTR1A
Hydrochloric Acid SCHEMBL8153895 0.85 GPR3 (0.41) GPR3HTR2AACHECHRM2HTR1A
Hydrochloric Acid SCHEMBL3894356 0.82 GPR3 (0.39) GPR3HTR2AACHECHRM2HTR1A
Hydrochloric Acid SCHEMBL4632310 0.80 ELANE (0.44) GPR3ACHECHRM2HTR1AADRA2A
SCHEMBL8774018 0.78 ACHE (0.41) GPR3HTR2AACHECHRM2HTR1A
Hydrochloric Acid SCHEMBL4633012 0.78 GPR3 (0.35) GPR3HTR2AACHECHRM2HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111747995-A Nitrogen-containing aryloxy cyclopentadienyl titanium compound and preparation method and application thereof 上海化工研究院有限公司 2020-10-09 CN disclosed
US-20120142988-A1 METHOD OF PRODUCING 1-HEXENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-06-07 US disclosed
US-7709586-B2 Olefin polymerization catalyst and olefin polymerization process using the same DAELIM INDUSTRIAL CO., LTD. (KR) 2010-05-04 US disclosed
EP-1520862-B1 Butadiene polymer, and process for producing conjugated diene polymer AGENCY IND SCIENCE TECHN (JP) 2008-05-28 EP disclosed
US-20070142221-A1 Olefin polymerization catalyst and olefin polymerization process using the same DAELIM INDUSTRIAL CO., LTD. 2007-06-21 US disclosed
EP-1153947-B1 OLEFIN COPOLYMER, FILM, AND SHEET IDEMITSU KOSAN CO (JP) 2007-06-13 EP disclosed
EP-1520862-A2 Butadiene polymer, and process for producing conjugated diene polymer JAPAN as Represented by DIRECTOR GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2005-04-06 EP disclosed
EP-1054026-B1 BUTADIENE POLYMERS AND PROCESS FOR PRODUCING CONJUGATED DIENE POLYMERS JP AGENCY OF INDUSTRIALSCIENCE (JP) 2004-12-08 EP disclosed
US-6812183-B1 TWO GROUP 3-10 TRANSITION METALS AND A DELOCALIZED DIANIONIC LIGAND PI-BONDED TO EACH OF THE METALS AND TWO OR MORE ANCILLARY LIGANDS BONDED TO EACH METAL THAT SATISFY THE VALENCE OF THE METALS. OLEFIN POLYMERIZATION EQUISTAR CHEMICALS, LP 2004-11-02 US disclosed
US-20040214716-A1 TRIPLE-DECKER CATALYSTS BASED ON DELOCALIZED DIANIONIC LIGANDS EQUISTAR CHEMICALS, LP 2004-10-28 US disclosed
US-6127302-A Unbridged monocyclopentadienyl metal complex catalyst and a process for polyolefin production UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2000-10-03 US disclosed
EP-1026176-A1 CATALYST FOR OLEFIN POLYMER PRODUCTION, PROCESS FOR PRODUCING THE SAME, AND PROCESS FOR PRODUCING OLEFIN POLYMER IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2000-08-09 EP disclosed
EP-0989139-A1 Unbridged monocyclopentadienyl metal complex catalyst for olefin polymerization by reacting with particulate solids with functional groups UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2000-03-29 EP disclosed
WO-2000006614-A1 UNBRIDGED MONOCYCLOPENTADIENYL METAL COMPLEX CATALYST HAVING IMPROVED TOLERANCE OF MODIFIED METHYLALUMINOXANE UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2000-02-10 WO disclosed
US-5962362-A COORDINATION CATALYST UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1999-10-05 US disclosed
WO-1999029741-A1 UNBRIDGED MONOCYCLOPENTADIENYL METAL COMPLEX CATALYST AND A PROCESS FOR POLYOLEFIN PRODUCTION UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1999-06-17 WO disclosed
WO-1999029740-A1 UNBRIDGED MONOCYCLOPENTADIENYL METAL COMPLEX CATALYST AND A PROCESS FOR POLYOLEFIN PRODUCTION UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY COR PORATION (US) 1999-06-17 WO disclosed
EP-0922711-A1 Unbridged monocyclopentadienyl metal complex catalyst and a process for polyolefin production UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1999-06-16 EP disclosed
US-5770666-A METALLOCENE TOSOH CORPORATION (JP) 1998-06-23 US disclosed
EP-0716092-A1 Organic transition metal compound and process for the preparation of polyolefin using same TOSOH CORPORATION (JP) 1996-06-12 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120142988-A1 METHOD OF PRODUCING 1-HEXENE HRH1, HK1, HMOX1 ACHE 612/4885CHRM2 1380/4885CHRM1 894/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.