Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9401440 | 0.86 | PTGES (0.40) | KMT2ASLC6A3 | |
| SCHEMBL9572237 | 0.82 | EDNRB (0.36) | CYP1A2CYP3A4 | |
| SCHEMBL9401323 | 0.82 | EDNRB (0.37) | AOC3CYP1A2CYP3A4SLC6A3 | |
| SCHEMBL9401354 | 0.81 | GAA (0.39) | CYP1A2 | |
| SCHEMBL9401376 | 0.81 | L3MBTL1 (0.34) | CYP1A2 | |
| SCHEMBL9401337 | 0.81 | EDNRB (0.38) | MEN1KMT2ACYP1A2ATM | |
| SCHEMBL9401386 | 0.81 | NPC1 (0.36) | — | |
| SCHEMBL9401387 | 0.81 | EDNRB (0.38) | AOC3 | |
| SCHEMBL9401330 | 0.81 | AOC3 (0.36) | AOC3 | |
| SCHEMBL9401343 | 0.79 | TP53 (0.33) | CYP1A2 |
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-5346880-A | Pre- and postemergence | NIHON BAYER AGROCHEM K.K. (JP) | 1994-09-13 | — | — | US | disclosed |
| EP-0565951-A1 | Herbicidally active pyrimidinylthioalkane derivatives | NIHON BAYER AGROCHEM K.K. (JP) | 1993-10-20 | — | — | EP | disclosed |