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)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CA3 | P07451 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29395660 | 0.96 | ALDH1A1 (0.40) | ALDH1A1TSHRTDP1CA1CA2 | |
| Fluoride Ion SCHEMBL3891341 | 0.92 | ALDH1A1 (0.39) | ALDH1A1TSHRTDP1CA1CA2 | |
| SCHEMBL29130047 | 0.83 | CYP3A4 (0.33) | ALDH1A1TDP1CA4CA14CA7 | |
| SCHEMBL30572496 | 0.83 | ALDH1A1 (0.32) | ALDH1A1TSHR | |
| SCHEMBL2863077 | 0.83 | CYP3A4 (0.33) | ALDH1A1TDP1CA4CA14CA7 | |
| SCHEMBL3292756 | 0.83 | ALDH1A1 (0.39) | ALDH1A1TSHRACHEALOX15 | |
| SCHEMBL3984229 | 0.83 | TSHR (0.35) | ALDH1A1TSHRLMNABBOX1EHMT2 | |
| SCHEMBL4817504 | 0.78 | CYP3A4 (0.30) | TDP1CYP3A4 | |
| SCHEMBL30437274 | 0.76 | ALDH1A1 (0.56) | ALDH1A1TSHRTDP1CA1CA2 | |
| Hydrochloric Acid SCHEMBL10747097 | 0.74 | ALDH1A1 (0.65) | ALDH1A1TSHRTDP1ALOX12LMNA |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004048388-A1 | TRIPHENYLCARBENIUM SALTS OF GROUP 13 FLUOROARYL COMPLEXES | DOW GLOBAL TECHNOLOGIES, INC. (US) | 2004-06-10 | — | — | WO | claimed |
| WO-2017099956-A1 | FUNCTIONAL FLUID COMPOSITIONS CONTAINING EROSION INHIBITORS | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2017-06-15 | — | — | WO | disclosed |
| US-20170158981-A1 | FUNCTIONAL FLUID COMPOSITIONS CONTAINING EROSION INHIBITORS | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY | 2017-06-08 | — | — | US | disclosed |
| WO-2011032681-A1 | LIPOPHILIC METALLATES | Universität Heidelberg (DE) | 2011-03-24 | — | — | WO | disclosed |
| US-7901074-B2 | Lens for safety glasses | YAMAMOTO KOGAKU CO., LTD. (JP) | 2011-03-08 | — | — | US | disclosed |
| EP-1979361-B1 | OXONIUM AND SULFONIUM SALTS | MERCK PATENT GMBH (DE) | 2010-11-24 | — | — | EP | disclosed |
| EP-2253638-A2 | Fluoralkylfluorophosphate salts | Merck Patent GmbH (DE) | 2010-11-24 | — | — | EP | disclosed |
| US-7585991-B2 | (Pentafluorophenyl) group 11 and 12 metal compounds, processes for preparing (pentafluorophenyl) group 11 and 12 metal compounds, and uses thereof | LEWIS STEWART P | 2009-09-08 | — | — | US | disclosed |
| EP-1979361-A2 | OXONIUM AND SULFONIUM SALTS | Merck Patent GmbH (DE) | 2008-10-15 | — | — | EP | disclosed |
| US-20080177015-A1 | (Pentafluorophenyl) group 11 and 12 metal compounds, processes for preparing (pentafluorophenyl) group 11 and 12 metal compounds, and uses thereof | LEWIS STEWART P | 2008-07-24 | — | — | US | disclosed |
| WO-2002012154-A2 | CATALYST SYSTEM FOR THE POLYMERISATION OF OLEFINS | BAYER AKTIENGESELLSCHAFT (DE) | 2002-02-14 | — | — | WO | disclosed |
| US-20020010079-A1 | POLYMERIC SUPPORTED CATALYSTS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. | 2002-01-24 | — | — | US | disclosed |
| US-6281389-B1 | MIXING WITH SOLVENT; DISTILLATION | NIPPON SHOKUBAI CO., LTD. (JP) | 2001-08-28 | — | — | US | disclosed |
| EP-1066329-A1 | POLYMERIC SUPPORTED CATALYSTS FOR OLEFIN POLYMERIZATION | EXXON CHEMICAL PATENTS INC. (US) | 2001-01-10 | — | — | EP | disclosed |
| EP-1066302-A1 | CYCLOPENTADIENYL TRANSITION METAL COMPOUNDS, AS POLYMERIZATION CATALYSTS | EASTMAN CHEMICAL COMPANY (US) | 2001-01-10 | — | — | EP | disclosed |
| US-6100414-A | Cyclopentadienyl transition metal compounds useful as polymerization catalysts | EASTMAN CHEMICAL COMPANY (US) | 2000-08-08 | — | — | US | disclosed |
| EP-0985672-A2 | Method for purifying tetrakis(fluoroaryl)borate compounds | Nippon Shokubai Co., Ltd. (JP) | 2000-03-15 | — | — | EP | disclosed |
| WO-1999051615-A1 | CYCLOPENTADIENYL TRANSITION METAL COMPOUNDS, AS POLYMERIZATION CATALYSTS | EASTMAN CHEMICAL COMPANY (US) | 1999-10-14 | — | — | WO | disclosed |
| WO-1999050311-A1 | POLYMERIC SUPPORTED CATALYSTS FOR OLEFIN POLYMERIZATION | EXXON CHEMICAL PATENTS INC. (US) | 1999-10-07 | — | — | WO | disclosed |
| US-4206067-A | Thermally stabilized erosion-inhibited functional fluids containing perhalometal compounds and an organic base | CHEVRON RESEARCH COMPANY (US) | 1980-06-03 | — | — | US | disclosed |