Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | F10 | P00742 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.41 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9818055 | 1.00 | HTT (0.45) | HTTL3MBTL1F2F10PRSS1 | |
| SCHEMBL9270503 | 0.85 | F2 (0.44) | HTTL3MBTL1F2F10PRSS1 | |
| SCHEMBL10548446 | 0.85 | F2 (0.44) | HTTL3MBTL1F2F10PRSS1 | |
| SCHEMBL9818071 | 0.85 | F2 (0.44) | HTTL3MBTL1F2F10PRSS1 | |
| SCHEMBL11391658 | 0.84 | MEN1 (0.45) | HTTL3MBTL1F2F10PRSS1 | |
| SCHEMBL8972539 | 0.83 | HTT (0.46) | HTTL3MBTL1F2F10PRSS1 | |
| SCHEMBL11377767 | 0.81 | L3MBTL1 (0.41) | HTTL3MBTL1F2F10PRSS1 | |
| SCHEMBL11163345 | 0.79 | HTT (0.43) | HTTL3MBTL1F2F10PRSS1 | |
| SCHEMBL9771159 | 0.75 | MAPK1 (0.48) | HTTL3MBTL1F2F10PRSS1 | |
| SCHEMBL38661913 | 0.74 | CYP3A4 (0.44) | KDM4ECYP3A4ALDH1A1HPGDSLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0298590-B1 | HALOGENATED ESTERS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-12-11 | — | — | EP | disclosed |
| EP-0298590-A1 | Halogenated esters | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-01-11 | — | — | EP | disclosed |