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 | |
|---|---|---|---|---|
| SCHEMBL29036594 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL29094329 | 0.93 | — | — | |
| SCHEMBL8595070 | 0.72 | — | — | |
| SCHEMBL7208598 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL28999240 | 0.68 | — | — | |
| SCHEMBL29012338 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL30454455 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL4326717 | 0.62 | — | — | |
| SCHEMBL125978 | 0.61 | KDM4E (0.31) | — | |
| Ammonia Solution, Strong SCHEMBL15018678 | 0.59 | KDM4E (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116033828-A | Heterocyclic derivatives as pest control agents | 拜耳公司 | 2023-04-28 | — | — | CN | disclosed |