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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL30525914 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL29556837 | 0.82 | PDCD1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL217395 | 0.82 | PDCD1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL7938585 | 0.82 | ADRA2A (0.30) | — | |
| Hydrochloric Acid SCHEMBL7217384 | 0.82 | — | — | |
| Hexane SCHEMBL8607037 | 0.78 | SOAT1 (0.31) | — | |
| SCHEMBL5189611 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL30203878 | 0.76 | CHRNB2 (0.31) | — | |
| Hydrochloric Acid SCHEMBL138389 | 0.76 | CHRNB2 (0.31) | — | |
| Hydrochloric Acid SCHEMBL5604826 | 0.76 | BRD4 (0.33) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015065784-A1 | NOVEL ALUMINUM ALKYL WITH C5 CYCLIC AND PENDENT OLEFIN POLYMERIZATION CATALYST | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2015-05-07 | — | — | WO | claimed |
| US-20150119540-A1 | Novel Aluminum Alkyl With C5 Cyclic and Pendent Olefin Polymerization Catalyst | EXXONMOBIL CHEMICAL PATENTS INC. | 2015-04-30 | — | — | US | claimed |
| US-7741417-B2 | Preparation of polymerization catalyst activators utilizing indole-modified silica supports | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2010-06-22 | — | — | US | claimed |
| US-20070055028-A1 | Preparation of polymerization catalyst activators utilizing indole-modified silica supports | EXXONMOBIL CHEMICAL PATENTS INC. | 2007-03-08 | — | — | US | claimed |
| US-9321854-B2 | Aluminum alkyl with C5 cyclic and pendent olefin polymerization catalyst | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2016-04-26 | — | — | US | disclosed |
| WO-2015065784-A1 | NOVEL ALUMINUM ALKYL WITH C5 CYCLIC AND PENDENT OLEFIN POLYMERIZATION CATALYST | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2015-05-07 | — | — | WO | disclosed |
| US-20150119540-A1 | Novel Aluminum Alkyl With C5 Cyclic and Pendent Olefin Polymerization Catalyst | EXXONMOBIL CHEMICAL PATENTS INC. | 2015-04-30 | — | — | US | disclosed |