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 SCHEMBL7198916 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL8207360 | 0.85 | BCHE (0.31) | — | |
| Hydrochloric Acid SCHEMBL811670 | 0.85 | BCHE (0.31) | — | |
| Hydrochloric Acid SCHEMBL8207383 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL7622884 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL5407574 | 0.79 | BCHE (0.31) | — | |
| Hydrochloric Acid SCHEMBL676961 | 0.78 | BCHE (0.31) | — | |
| Hydrochloric Acid SCHEMBL6438900 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL7938087 | 0.75 | ADRA2C (0.32) | — | |
| Hydrochloric Acid SCHEMBL7193926 | 0.75 | ADRA2C (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6277778-B1 | COORDINATION CATALYSTS | BOREALIS A/S (DK) | 2001-08-21 | — | — | US | disclosed |
| EP-0975644-A1 | SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION CATALYST SYSTEMS, THEIR INTERMEDIATES AND METHODS FOR PREPARING THEM | BOREALIS A/S (DK) | 2000-02-02 | — | — | EP | disclosed |
| WO-1998046616-A1 | SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION CATALYST SYSTEMS, THEIR INTERMEDIATES AND METHODS FOR PREPARING THEM | BOREALIS A/S (DK) | 1998-10-22 | — | — | WO | disclosed |