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 | |
|---|---|---|---|---|
| SCHEMBL9566018 | 0.66 | CTSD (0.34) | — | |
| Hydrochloric Acid SCHEMBL7947952 | 0.66 | CTSD (0.30) | — | |
| SCHEMBL8459161 | 0.65 | — | — | |
| Acetone SCHEMBL10324588 | 0.60 | CTSD (0.33) | — | |
| SCHEMBL2230540 | 0.59 | CTSD (0.43) | — | |
| Acetic Acid SCHEMBL7760494 | 0.58 | CTSD (0.32) | — | |
| Acetic Acid SCHEMBL7760489 | 0.57 | CA1 (0.35) | — | |
| SCHEMBL4750061 | 0.57 | CTSD (0.31) | — | |
| Hydrochloric Acid SCHEMBL564018 | 0.57 | CTSD (0.33) | — | |
| SCHEMBL9566021 | 0.57 | — | — |
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-5807940-A | Catalyst for polymerization and process for producing a styrenic polymer by using the catalyst | IDEMITSU KOSAN CO., LTD. (JP) | 1998-09-15 | — | — | US | disclosed |
| EP-0739905-B1 | POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING STYRENE POLYMER THEREWITH | IDEMITSU KOSAN CO (JP) | 1998-07-08 | — | — | EP | disclosed |
| EP-0739905-A1 | POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING STYRENE POLYMER THEREWITH | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1996-10-30 | — | — | EP | disclosed |