Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.66 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CDK9 | P50750 | 1/20 | 0.52 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.52 |
| ▸ | KDM1A | O60341 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | SCN1A | P35498 | 1/20 | 0.52 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.52 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL15612337 | 0.94 | CYP1A2 (0.60) | CYP3A4CYP1A2CYP2D6EPHX2MEN1 | |
| SCHEMBL15612046 | 0.89 | CYP1A2 (0.55) | CYP3A4CYP1A2CYP2D6EPHX2MEN1 | |
| SCHEMBL8375614 | 0.83 | EPHX2 (0.57) | CYP3A4CYP1A2CYP2D6EPHX2MEN1 | |
| SCHEMBL4813925 | 0.82 | CYP3A4 (0.81) | CYP3A4CYP1A2CYP2D6EPHX2MEN1 | |
| SCHEMBL10784058 | 0.82 | EPHX2 (0.52) | CYP3A4CYP1A2CYP2D6EPHX2MEN1 | |
| SCHEMBL11412618 | 0.82 | EPHX2 (0.55) | EPHX2MAPTL3MBTL1HTTSMN1; SMN2 | |
| SCHEMBL1260216 | 0.82 | SMN1; SMN2 (0.62) | CYP1A2EPHX2MEN1KMT2AMAPT | |
| SCHEMBL11250189 | 0.80 | SMN1; SMN2 (0.60) | CYP3A4CYP1A2CYP2D6EPHX2MEN1 | |
| SCHEMBL22231489 | 0.80 | GAA (0.59) | MEN1KMT2AMAPTSMN1; SMN2TP53 | |
| SCHEMBL1689206 | 0.80 | EPHX2 (0.68) | CYP3A4EPHX2MEN1KMT2AMAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0834499-B1 | Process for the preparation of aromatic vinyl compounds | DAINIPPON INK & CHEMICALS (JP) | 2001-07-25 | — | — | EP | disclosed |
| EP-0834499-A1 | Process for the preparation of aromatic vinyl compounds | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1998-04-08 | — | — | EP | disclosed |
| US-4661632-A | Halogenopropargylformamide pesticides | BAYER AKTIENGESELLSCHAFT (DE) | 1987-04-28 | — | — | US | disclosed |
| EP-0094539-B1 | HALOGENOPROPARGYL FORMAMIDES | BAYER AG (DE) | 1985-08-21 | — | — | EP | disclosed |
| EP-0094539-A1 | Halogenopropargyl formamides | BAYER AG (DE) | 1983-11-23 | — | — | EP | disclosed |