Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.56 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.53 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.53 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.53 |
| ▸ | AKT1 | P31749 | 1/20 | 0.51 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | STAT1 | P42224 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.45 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.45 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27656250 | 0.91 | CYP11B1 (0.57) | CYP2A6CYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL22673549 | 0.90 | CYP11B2 (0.61) | CYP2A6CYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL4088289 | 0.82 | CYP2A6 (0.58) | CYP2A6CYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL13727185 | 0.82 | CYP2A6 (0.58) | CYP2A6CYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL13727413 | 0.82 | CYP2A6 (0.58) | CYP2A6CYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL3359420 | 0.82 | PSMB5 (0.65) | AKT1PSMB5ALDH1A1HPGDCYP3A4 | |
| SCHEMBL29374375 | 0.82 | PSMB5 (0.65) | AKT1PSMB5ALDH1A1HPGDCYP3A4 | |
| SCHEMBL4361764 | 0.81 | PDE10A (0.51) | CYP2A6CYP11B1CYP11B2AKT1PSMB5 | |
| SCHEMBL13726649 | 0.81 | CYP11B1 (0.51) | CYP2A6CYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL13727554 | 0.81 | CYP11B1 (0.51) | CYP2A6CYP11B1CYP11B2CYP19A1CYP17A1 |
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-109689665-A | Metal complex and electron transport material using the same | 大电株式会社 | 2019-04-26 | — | — | CN | disclosed |