Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5345926

Cc1ccc([Zr+3])c2c1-c1ccccc1C2.[Cl-].[Cl-].[Cl-]

nearest known ligand 0.41

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 1/20 0.33
MAP3K9 P80192 5/20 0.41
MAP3K11 Q16584 5/20 0.41
PNMT P11086 1/20 0.38
PGR P06401 1/20 0.35
MAOA P21397 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
ALDH1A1 P00352 3/20 0.33
BCHE P06276 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KMT2A Q03164 2/20 0.33

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
SCHEMBL8857148 0.83 PNMT (0.43) MAP3K9MAP3K11PNMTPGRMAOA
SCHEMBL29859431 0.83 PNMT (0.43) MAP3K9MAP3K11PNMTPGRMAOA
Hydrochloric Acid SCHEMBL9579948 0.81 MAP3K9 (0.41) MAP3K9MAP3K11PNMTPGRMAOA
Hydrochloric Acid SCHEMBL5358974 0.80 PNMT (0.42) MAP3K9MAP3K11PNMTPGRMAOA
Hydrochloric Acid SCHEMBL7251521 0.79 MAP3K9 (0.41) MAP3K9MAP3K11PNMTPGRMAOA
SCHEMBL9841135 0.79 PGR (0.40) MAP3K9MAP3K11PNMTPGRMAOA
SCHEMBL9579942 0.78 PNMT (0.37) MAP3K9MAP3K11PNMTPGRMAOA
Hydrochloric Acid SCHEMBL8155675 0.78 MAP3K9 (0.40) MAP3K9MAP3K11PNMTPGRMAOA
Hydrochloric Acid SCHEMBL5358545 0.78 MAP3K9 (0.40) MAP3K9MAP3K11PNMTPGRMAOA
Hydrochloric Acid SCHEMBL5347494 0.78 MAP3K9 (0.40) MAP3K9MAP3K11PNMTPGRMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7230128-B2 Organometallic fluorenyl compounds, preparations, and use PHILLIPS POTROLEUM COMPANY (US) 2007-06-12 US disclosed
US-20060122344-A1 Organometallic Fluorenyl Compounds, Preparations, and Use PHILLIPS PETROLEUM COMPANY (US) 2006-06-08 US disclosed
EP-1304319-A2 Metallocenes and processes therefor and therewith Phillips Petroleum Company (US) 2003-04-23 EP disclosed
EP-0628566-B1 Metallocenes and processes therefor and therewith PHILLIPS PETROLEUM CO (US) 2003-03-26 EP disclosed
EP-0628577-B2 Silyl bridged metallocenes and use thereof PHILLIPS PETROLEUM CO (US) 2002-10-09 EP disclosed
US-6420579-B1 SILYL, GERMANIUM OR TIN RADICALS WITH TITANIUM, ZIRCONIUM, HAFNIUM, VANADIUM, NIOBIUM AND TANTALUM METALS PHILLIPS PETROLEUM COMPANY 2002-07-16 US disclosed
US-6403734-B1 POLYMERIZING ALPHA-OLEFIN BY CONTACTING WITH CATALYST SYSTEM COMPRISING BRIDGED FLUORENYL METALLOCENE CONTAINING METAL OF GROUP 4 OR 5 AND SUITABLE COCATALYST PHILLIPS PETROLEUM COMPANY 2002-06-11 US disclosed
EP-0524624-B1 Use of organometallic flurorenyl compounds. PHILLIPS PETROLEUM CO (US) 2002-05-15 EP disclosed
EP-1123938-A2 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 2001-08-16 EP disclosed
EP-0666267-B1 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 2001-04-18 EP disclosed
US-5451649-A Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1995-09-19 US disclosed
EP-0666267-A2 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1995-08-09 EP disclosed
US-5436305-A Preparing polymer catalysts by reaction of alkali metal alkyl and fluorenyl in solvent PHILLIPS PETROLEUM COMPANY (US) 1995-07-25 US disclosed
US-5401817-A Syndiotactic polypropylene PHILLIPS PETROLEUM COMPANY (US) 1995-03-28 US disclosed
EP-0628577-A2 Silyl bridged metallocenes and use thereof PHILLIPS PETROLEUM COMPANY (US) 1994-12-14 EP disclosed
EP-0628566-A1 Metallocenes and processes therefor and therewith PHILLIPS PETROLEUM COMPANY (US) 1994-12-14 EP disclosed
EP-0628565-A1 Bis fluorenyl metallocenes and use thereof PHILLIPS PETROLEUM COMPANY (US) 1994-12-14 EP disclosed
EP-0627440-A1 9-Substituted fluorenyl compounds and the preparation and use of metallocenes thereof PHILLIPS PETROLEUM COMPANY (US) 1994-12-07 EP disclosed
CN-1068829-A Organometallic fluorenyl compounds and preparation thereof and application PHILLIPS PETROLEUM CO (US) 1993-02-10 CN disclosed
EP-0524624-A2 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1993-01-27 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-20060122344-A1 Organometallic Fluorenyl Compounds, Preparations, and Use HMBS, FDPS, SOD1 ACHE 440/4885MAP3K9 3601/4885MAP3K11 3799/4885

“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.