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.
Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.67 |
| ▸ | BCHE | P06276 | 1/20 | 0.65 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | GBA1 | P04062 | 1/20 | 0.49 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 SCHEMBL709918 | 0.97 | TDP1 (0.67) | TDP1BCHEDDAH1POLBPKM | |
| SCHEMBL711939 | 0.96 | TDP1 (0.70) | TDP1BCHEDDAH1POLBPKM | |
| Hydrochloric Acid SCHEMBL709917 | 0.93 | TDP1 (0.71) | TDP1BCHEDDAH1POLBPKM | |
| Hydrochloric Acid SCHEMBL708640 | 0.93 | TDP1 (0.71) | TDP1BCHEDDAH1POLBPKM | |
| SCHEMBL708642 | 0.90 | TDP1 (0.63) | TDP1BCHEDDAH1POLBPKM | |
| SCHEMBL23303404 | 0.90 | BCHE (0.70) | TDP1BCHEDDAH1POLBPKM | |
| SCHEMBL23336458 | 0.87 | BCHE (0.66) | TDP1BCHEDDAH1POLBPKM | |
| SCHEMBL4118942 | 0.86 | BCHE (0.69) | TDP1BCHEDDAH1POLBPKM | |
| SCHEMBL1333203 | 0.84 | BCHE (0.82) | TDP1BCHEDDAH1POLBPKM | |
| SCHEMBL7339555 | 0.83 | TDP1 (0.63) | TDP1BCHEDDAH1POLBPKM |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1910426-B1 | DIENE POLYMERISATION | INEOS SALES (UK) LTD (GB) | 2018-01-03 | — | — | EP | disclosed |
| US-8648000-B2 | Diene polymerisation | INEOS COMMERCIAL SERVICES UK LIMITED (GB) | 2014-02-11 | — | — | US | disclosed |
| WO-2012035546-A3 | A TAMPER EVIDENT MULTIPLE METALLIZED AND DEMETALLIZED SECURITY DEVICE AND PROCESS FOR PREPARING THE SAME | KAPOOR AJAY (IN) | 2012-05-10 | — | — | WO | disclosed |
| US-8124698-B2 | Diene polymerisation | INEOS EUROPE LIMITED (GB) | 2012-02-28 | — | — | US | disclosed |
| EP-1918312-B1 | Diene polymerisation | INEOS COMMERCIAL SERVICES UK (GB) | 2011-12-07 | — | — | EP | disclosed |
| US-20100022724-A1 | Diene Polymerisation | INEOS SALES (UK) LIMITED (GB) | 2010-01-28 | — | — | US | disclosed |
| US-20080293896-A1 | Diene polymerisation | INEOS SALES (UK) LIMITED (GB) | 2008-11-27 | — | — | US | disclosed |
| EP-1918312-A1 | Diene polymerisation | INEOS EUROPE LIMITED (GB) | 2008-05-07 | — | — | EP | disclosed |
| EP-1918311-A1 | Diene polymerisation | INEOS EUROPE LIMITED (GB) | 2008-05-07 | — | — | EP | disclosed |
| EP-1910426-A1 | DIENE POLYMERISATION | INEOS EUROPE LIMITED (GB) | 2008-04-16 | — | — | EP | disclosed |
| WO-2007015074-A1 | DIENE POLYMERISATION | INEOS EUROPE LIMITED (GB) | 2007-02-08 | — | — | WO | disclosed |