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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL8768571 | 0.99 | — | — | |
| Hydrochloric Acid SCHEMBL5079593 | 0.91 | — | — | |
| SCHEMBL6231436 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL18690029 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL5084095 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL5079615 | 0.85 | — | — | |
| SCHEMBL18420601 | 0.84 | — | — | |
| SCHEMBL6231654 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL18689972 | 0.83 | PPARD (0.31) | — | |
| Hydrochloric Acid SCHEMBL18689998 | 0.83 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6313240-B1 | ETHYLENE IS COPOLYMERIZED WITH AN .ALPHA.-OLEFIN HAVING THREE OR MORE CARBONS BY USE OF AN OLEFIN POLYMERIZATION CATALYST COMPRISING HAFNIUM METALLOCENE COMPOUND, IONIZING COMPOUND, OGRANOALUMINUM COMPOUND | TOSOH CORPORATION (JP) | 2001-11-06 | — | — | US | disclosed |
| EP-0612768-B1 | Process for producing ethylene/alpha-olefin copolymer | TOSOH CORP (JP) | 1997-11-12 | — | — | EP | disclosed |
| US-5576259-A | POLYMERIZATION CATALYST INCLUDING METALLOCENE COMPOUND, IONIC COMPOUND, ORGANOALUMINUM COMPOUND, AND LEWIS BASE | TOSOH CORPORATION (JP) | 1996-11-19 | — | — | US | disclosed |
| EP-0708117-A1 | Process for producing copolymer rubber | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1996-04-24 | — | — | EP | disclosed |
| EP-0612768-A1 | Process for producing ethylene/alpha-olefin copolymer | TOSOH CORPORATION (JP) | 1994-08-31 | — | — | EP | disclosed |