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 | |
|---|---|---|---|---|
| SCHEMBL9577509 | 0.70 | — | — | |
| SCHEMBL9577511 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL4478116 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL7639743 | 0.68 | — | — | |
| SCHEMBL4451763 | 0.66 | — | — | |
| SCHEMBL9319115 | 0.54 | TP53 (0.30) | — | |
| Hydrochloric Acid SCHEMBL7212620 | 0.54 | — | — | |
| SCHEMBL9064078 | 0.53 | — | — | |
| Hydrochloric Acid SCHEMBL4885097 | 0.52 | — | — | |
| Hydrochloric Acid SCHEMBL4467798 | 0.52 | ACHE (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040097366-A1 | Polyolefin-based composite resin, method for production thereof, catalyst for polymerization of vinly compound and method for polymerization of vinly compound using the same | IDEMITSU KOSAN CO. LTD. (JP) | 2004-05-20 | — | — | US | disclosed |