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 | |
|---|---|---|---|---|
| SCHEMBL5619130 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL5486777 | 0.70 | ABCG2 (0.51) | — | |
| Indene SCHEMBL3498848 | 0.69 | CA1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL4525487 | 0.66 | ABCG2 (0.30) | — | |
| Hydrochloric Acid SCHEMBL4447986 | 0.64 | — | — | |
| SCHEMBL29541078 | 0.63 | IDO1 (0.32) | — | |
| SCHEMBL1820516 | 0.63 | IDO1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL3681016 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL6152625 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL6557787 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1951770-B1 | POLYOLEFIN COMPOSITIONS | EQUISTAR CHEM LP (US) | 2010-06-09 | — | — | EP | disclosed |
| US-7538173-B2 | Polyolefin compositions | EQUISTAR CHEMICALS LP (US) | 2009-05-26 | — | — | US | disclosed |
| US-20070117946-A1 | Polyolefin compositions | EQUISTAR CHEMICALS, LP | 2007-05-24 | — | — | US | disclosed |