Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17802455 | 0.75 | HSD17B10 (0.43) | CYP3A4CYP1A2CYP2C19LMNAHSD17B10 | |
| SCHEMBL17802492 | 0.69 | CYP19A1 (0.52) | CYP3A4CYP1A2CYP2C19LMNAHSD17B10 | |
| SCHEMBL17802472 | 0.67 | NPC1 (0.52) | CYP3A4CYP1A2CYP2C19LMNAHSD17B10 | |
| SCHEMBL17802478 | 0.67 | RAB9A (0.52) | CYP3A4CYP1A2CYP2C19LMNAKDM4E | |
| SCHEMBL20375537 | 0.67 | CYP3A4 (0.40) | CYP3A4CYP1A2CYP2C19LMNAKDM4E | |
| SCHEMBL17802503 | 0.66 | RAB9A (0.49) | CYP3A4CYP1A2CYP2C19LMNAKDM4E | |
| SCHEMBL17802493 | 0.66 | CYP1A2 (0.52) | CYP3A4CYP1A2CYP2C19LMNAKDM4E | |
| SCHEMBL17802497 | 0.65 | NPC1 (0.47) | KDM4ENPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL17802462 | 0.65 | RAB9A (0.47) | L3MBTL1NPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL17802499 | 0.64 | NPC1 (0.49) | CYP3A4CYP1A2CYP2C19LMNATSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3227302-B1 | BICYCLIC COMPOUNDS AS PEST CONTROLLERS | BAYER CROPSCIENCE AG (DE) | 2018-07-11 | — | — | EP | disclosed |