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 | |
|---|---|---|---|---|
| SCHEMBL2224147 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL6090204 | 0.82 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL20450715 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL9102962 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL28761118 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL28171167 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL28249959 | 0.68 | ALDH1A1 (0.33) | — | |
| SCHEMBL23295164 | 0.67 | — | — | |
| SCHEMBL9716547 | 0.67 | — | — | |
| SCHEMBL5068410 | 0.67 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5206314-A | Reacting group 2 metal dihalide with group 4 or 5 transition metal hydrocarbyloxide, then organoaluminum precipitating agent, ester, halogen-containing activator | PHILLIPS PETROLEUM COMPANY (US) | 1993-04-27 | — | — | US | claimed |
| EP-0585851-B1 | Polyolefin polymerization process, method of producing catalyst, and catalyst | PHILLIPS PETROLEUM CO (US) | 1997-05-14 | — | — | EP | disclosed |
| EP-0430154-B1 | Polyolefin polymerization catalyst and method of production and use | PHILLIPS PETROLEUM CO (US) | 1996-02-28 | — | — | EP | disclosed |
| EP-0585851-A1 | Polyolefin polymerization process, method of producing catalyst, and catalyst | PHILLIPS PETROLEUM COMPANY (US) | 1994-03-09 | — | — | EP | disclosed |
| US-5235011-A | Coordination catalyst | PHILLIPS PETROLEUM COMPANY (US) | 1993-08-10 | — | — | US | disclosed |
| US-5206314-A | Reacting group 2 metal dihalide with group 4 or 5 transition metal hydrocarbyloxide, then organoaluminum precipitating agent, ester, halogen-containing activator | PHILLIPS PETROLEUM COMPANY (US) | 1993-04-27 | — | — | US | disclosed |
| EP-0430154-A2 | Polyolefin polymerization catalyst and method of production and use | PHILLIPS PETROLEUM COMPANY (US) | 1991-06-05 | — | — | EP | disclosed |
| US-4988655-A | A coordination catalyst for polymerization of alpha-olefins made from a magnesium dihalide, a phenol, an alkylbenzoate, a titanium compound and an aluminum compound | PHILLIPS PETROLEUM COMPANY (US) | 1991-01-29 | — | — | US | disclosed |