Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 6/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CKS1B | P61024 | 2/20 | 0.41 |
| ▸ | SKP2 | Q13309 | 2/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10016740 | 0.86 | CYP11B1 (0.53) | CYP11B1CYP11B2CYP3A4CYP2A6ALDH1A1 | |
| SCHEMBL2813022 | 0.86 | CYP2A6 (0.52) | CYP11B1CYP11B2CYP3A4CYP2A6ALDH1A1 | |
| SCHEMBL13907276 | 0.84 | CYP11B1 (0.66) | CYP11B1CYP11B2CYP3A4CYP2A6ALDH1A1 | |
| SCHEMBL17320748 | 0.83 | CYP2A6 (0.50) | CYP11B1CYP11B2CYP3A4CYP2A6ALDH1A1 | |
| SCHEMBL18165295 | 0.83 | CYP11B1 (0.49) | CYP11B1CYP11B2CYP3A4CYP2A6ALDH1A1 | |
| SCHEMBL22007100 | 0.81 | CYP11B1 (0.51) | CYP11B1CYP11B2CYP3A4CYP2A6ALDH1A1 | |
| SCHEMBL22470317 | 0.81 | CYP2A6 (0.52) | CYP11B1CYP11B2CYP3A4CYP2A6ALDH1A1 | |
| SCHEMBL10016791 | 0.81 | CYP11B1 (0.54) | CYP11B1CYP11B2CYP3A4CYP2A6ALDH1A1 | |
| SCHEMBL27845495 | 0.81 | IMPDH2 (0.43) | ALDH1A1NPC1RAB9AGSK3BDYRK1A | |
| SCHEMBL17539980 | 0.81 | CYP11B1 (0.51) | CYP11B1CYP11B2CYP3A4CYP2A6ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102382042-A | Anthracene derivant and organic electroluminescence element using same | JNC KK | 2012-03-21 | — | — | CN | disclosed |