Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 2/20 | 0.58 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.51 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.42 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.42 |
| ▸ | TOP1 | P11387 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Quinoline SCHEMBL28340669 | 0.88 | TNF (0.77) | TNFIKBKETBK1ALDH1A1CYP2A6 | |
| SCHEMBL6998015 | 0.87 | TNF (0.73) | TNFIKBKETBK1ALDH1A1KDM4E | |
| Quinoline SCHEMBL27278136 | 0.85 | PRKCZ (0.55) | TNFIKBKETBK1ALDH1A1CYP2A6 | |
| SCHEMBL12074747 | 0.84 | TNF (0.69) | TNFIKBKETBK1ALDH1A1KDM4E | |
| SCHEMBL27920029 | 0.81 | PDGFRB (0.59) | TNFIKBKETBK1CYP2A6KDM4E | |
| Quinoline SCHEMBL28895783 | 0.81 | ALDH1A1 (0.71) | TNFALDH1A1CYP2A6KDM4ELMNA | |
| SCHEMBL17945511 | 0.80 | TNF (0.63) | TNFIKBKETBK1ALDH1A1KDM4E | |
| SCHEMBL15835309 | 0.79 | KDM4E (0.56) | TNFIKBKETBK1ALDH1A1CYP2A6 | |
| Quinoline SCHEMBL28089647 | 0.79 | CYP3A4 (0.54) | TNFALDH1A1KDM4ELMNACYP3A4 | |
| SCHEMBL17944989 | 0.79 | NPC1 (0.46) | TNFIKBKETBK1ALDH1A1CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108017479-A | The manufacture method of aromatic compound | 东曹株式会社 | 2018-05-11 | — | — | CN | disclosed |
| CN-1275979-A | Isoquinoline compounds useful as urokinase inhibitors | PFIZER (US) | 2000-12-06 | — | — | CN | disclosed |