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 SCHEMBL6275796 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL2050242 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL29560682 | 0.79 | GPR3 (0.40) | — | |
| Hydrochloric Acid SCHEMBL3644681 | 0.79 | GPR3 (0.40) | — | |
| Hydrochloric Acid SCHEMBL4038972 | 0.77 | — | — | |
| Fluoride Ion SCHEMBL1130436 | 0.75 | GPR3 (0.40) | — | |
| Hydrochloric Acid SCHEMBL31126406 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL7030004 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL30525926 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL2232970 | 0.75 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7964679-B2 | 1-Butene polymer polymerization catalyst system: a Hf, Ti or Zr metallocene having an indene ring and a fluorene ring bridged by a silane group; an alumoxane or a compound that forms an alkyl metallocene cation; and an organoaluminum compound; (2,4,6-trimethylindenyl)(9-fluorenyl)dimethylsilane | BASELL POLIOLEFINE ITALIA S.R.L. (IT) | 2011-06-21 | — | — | US | disclosed |
| US-20080269439-A1 | Process for the Polymerization of Alpha Olefins | BASELL POLYOLEFINE GMBH (DE) | 2008-10-30 | — | — | US | disclosed |