Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.63 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.59 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | ALPL | P05186 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.48 |
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 SCHEMBL711744 | 0.97 | BCHE (0.59) | BCHEDDAH1CXCR4POLBTDP1 | |
| Hydrochloric Acid SCHEMBL711745 | 0.97 | BCHE (0.59) | BCHEDDAH1CXCR4POLBTDP1 | |
| SCHEMBL5181859 | 0.87 | BCHE (0.59) | BCHEDDAH1CXCR4POLBTDP1 | |
| SCHEMBL11858928 | 0.86 | CXCR4 (0.70) | BCHEDDAH1CXCR4POLBTDP1 | |
| SCHEMBL12089160 | 0.85 | BCHE (0.61) | BCHEDDAH1CXCR4POLBTDP1 | |
| SCHEMBL11995137 | 0.83 | BCHE (0.63) | BCHEDDAH1CXCR4POLBTDP1 | |
| SCHEMBL711939 | 0.81 | TDP1 (0.70) | BCHEDDAH1POLBTDP1PKM | |
| SCHEMBL4118942 | 0.81 | BCHE (0.69) | BCHEDDAH1POLBTDP1PKM | |
| SCHEMBL370724 | 0.80 | BCHE (0.86) | BCHEDDAH1POLBTDP1PKM | |
| SCHEMBL29550341 | 0.80 | BCHE (0.86) | BCHEDDAH1POLBTDP1PKM |
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-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 |