Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | CDC25B | P30305 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CCR6 | P51684 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.36 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1635668 | 0.76 | AKR1C3 (0.42) | AKR1C3GAAMAPTALDH1A1NPC1 | |
| SCHEMBL29855934 | 0.75 | NPC1 (0.66) | AKR1C3GAAMAPTALDH1A1NPC1 | |
| SCHEMBL4444737 | 0.75 | NPC1 (0.66) | AKR1C3GAAMAPTALDH1A1NPC1 | |
| SCHEMBL1200740 | 0.74 | AKR1C3 (0.55) | AKR1C3GAAMAPTALDH1A1ATM | |
| SCHEMBL16796019 | 0.72 | AKR1C3 (0.48) | AKR1C3GAAMAPTALDH1A1NPC1 | |
| SCHEMBL1331831 | 0.72 | AKR1C3 (0.57) | AKR1C3GAAMAPTALDH1A1ATM | |
| SCHEMBL64069 | 0.72 | AKR1C3 (0.57) | AKR1C3GAAMAPTALDH1A1ATM | |
| SCHEMBL11070653 | 0.71 | MAPT (0.49) | AKR1C3GAAMAPTALDH1A1NPC1 | |
| SCHEMBL3644022 | 0.71 | AKR1C3 (0.47) | AKR1C3GAAMAPTALDH1A1NPC1 | |
| SCHEMBL16994140 | 0.71 | AKR1C3 (0.47) | AKR1C3GAAMAPTALDH1A1NPC1 |
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-2042506-A1 | SUBSTITUTED PHENYLETHYNYL GOLD-NITROGENATED HETEROCYCLIC CARBENE COMPLEX | Ube Industries, Ltd. (JP) | 2009-04-01 | — | — | EP | disclosed |