Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR8 | P51685 | 1/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | SLC2A1 | P11166 | 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 | |
|---|---|---|---|---|
| SCHEMBL6976574 | 0.93 | CCR8 (0.49) | CCR8ROCK2KCNH2CYP2D6KDM4E | |
| SCHEMBL6976570 | 0.93 | CCR8 (0.49) | CCR8ROCK2KCNH2CYP2D6KDM4E | |
| SCHEMBL6965118 | 0.87 | CCR8 (0.50) | CCR8KCNH2SLC2A1 | |
| SCHEMBL7081967 | 0.87 | CCR8 (0.47) | CCR8KCNH2CYP2D6KDM4EALDH1A1 | |
| SCHEMBL11085539 | 0.86 | CYP2D6 (0.48) | CCR8ROCK2KCNH2CYP2D6KDM4E | |
| SCHEMBL6977170 | 0.85 | CCR8 (0.53) | CCR8ROCK2KCNH2CYP2D6KDM4E | |
| SCHEMBL6977177 | 0.85 | CCR8 (0.53) | CCR8ROCK2KCNH2CYP2D6KDM4E | |
| SCHEMBL6977174 | 0.85 | CCR8 (0.53) | CCR8ROCK2KCNH2CYP2D6KDM4E | |
| SCHEMBL6977251 | 0.85 | CCR8 (0.48) | CCR8ROCK2KCNH2CYP2D6KDM4E | |
| SCHEMBL6969141 | 0.84 | KCNH2 (0.55) | CCR8KCNH2SLC2A1 |
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-1051413-B1 | QUINOLINE DERIVATIVES AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2003-06-04 | — | — | EP | claimed |