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 SCHEMBL616319 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL4443640 | 0.67 | — | — | |
| Ethylene SCHEMBL649443 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL4939168 | 0.67 | HPGD (0.31) | — | |
| Fluoride Ion SCHEMBL1130389 | 0.66 | — | — | |
| Bromide SCHEMBL7889956 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL5969054 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL7787499 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL31169747 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL6751293 | 0.64 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6617466-B1 | Having a heteroatom ligand containing an element with a coordination number of three from Group V A or a coordination number of two from Group VI A attached to the ring through a hydrocarbylene, silane or germanium group | EXXONMOBIL CHEMICAL PATENTS INC. | 2003-09-09 | — | — | US | claimed |
| US-9139794-B2 | Process for the production of polymeric compositions useful as oil modifiers | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2015-09-22 | — | — | US | disclosed |
| US-20130203641-A1 | Process for the Production of Polymeric Compositions Useful as Oil Modifiers | EXXONMOBIL CHEMICAL PATENTS INC. | 2013-08-08 | — | — | US | disclosed |
| EP-0538749-B1 | Propylene copolymer composition | MITSUBISHI PETROCHEMICAL CO (JP) | 1995-01-11 | — | — | EP | disclosed |
| US-5331054-A | Blends; heat sealing film for packaging | MITSUBISHI PETROCHEMICAL COMPANY, LTD. (JP) | 1994-07-19 | — | — | US | disclosed |
| EP-0538749-A1 | Propylene copolymer composition | MITSUBISHI PETROCHEMICAL CO., LTD. (JP) | 1993-04-28 | — | — | EP | disclosed |