Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.65 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 4/20 | 0.56 |
| ▸ | RAB9A | P51151 | 4/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5137719 | 0.98 | BCHE (0.63) | BCHEGAADDAH1POLBNPC1 | |
| Hydrochloric Acid SCHEMBL710872 | 0.97 | BCHE (0.61) | BCHEGAADDAH1POLBNPC1 | |
| Hydrochloric Acid SCHEMBL710873 | 0.97 | BCHE (0.61) | BCHEGAADDAH1POLBNPC1 | |
| SCHEMBL7337463 | 0.94 | GAA (0.59) | BCHEGAADDAH1POLBNPC1 | |
| SCHEMBL370724 | 0.82 | BCHE (0.86) | BCHEGAADDAH1POLBNPC1 | |
| SCHEMBL29550341 | 0.82 | BCHE (0.86) | BCHEGAADDAH1POLBNPC1 | |
| Magnesium SCHEMBL30119882 | 0.80 | BCHE (0.83) | BCHEGAADDAH1POLBNPC1 | |
| SCHEMBL4118942 | 0.79 | BCHE (0.69) | BCHEGAADDAH1POLBNPC1 | |
| SCHEMBL8201381 | 0.79 | BCHE (1.00) | BCHEGAADDAH1POLBNPC1 | |
| SCHEMBL711939 | 0.79 | TDP1 (0.70) | BCHEGAADDAH1POLBNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1910426-B1 | DIENE POLYMERISATION | INEOS SALES (UK) LTD (GB) | 2018-01-03 | — | — | EP | disclosed |
| US-8124698-B2 | Diene polymerisation | INEOS EUROPE LIMITED (GB) | 2012-02-28 | — | — | US | disclosed |
| US-20100022724-A1 | Diene Polymerisation | INEOS SALES (UK) LIMITED (GB) | 2010-01-28 | — | — | US | disclosed |