Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR8 | P51685 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | SLC22A1 | O15245 | 3/20 | 0.48 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.48 |
| ▸ | SCN1A | P35498 | 3/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.48 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.48 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | SLC22A2 | O15244 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6976924 | 1.00 | CCR8 (0.48) | CCR8CYP2D6KDM4EALDH1A1SLC22A1 | |
| SCHEMBL6972259 | 0.91 | KCNH2 (0.53) | CYP2D6KDM4EALDH1A1SLC22A1ABCB11 | |
| SCHEMBL6972265 | 0.91 | KCNH2 (0.53) | CYP2D6KDM4EALDH1A1SLC22A1ABCB11 | |
| SCHEMBL6968990 | 0.89 | CCR8 (0.51) | CCR8CYP2D6KDM4EALDH1A1ADRA2A | |
| SCHEMBL6968986 | 0.89 | CCR8 (0.51) | CCR8CYP2D6KDM4EALDH1A1ADRA2A | |
| SCHEMBL6970395 | 0.88 | CCR8 (0.47) | CCR8CYP2D6KDM4EALDH1A1SLC22A1 | |
| SCHEMBL6970402 | 0.88 | CCR8 (0.47) | CCR8CYP2D6KDM4EALDH1A1SLC22A1 | |
| SCHEMBL6977808 | 0.87 | CYP3A4 (0.48) | CCR8CYP2D6KDM4EALDH1A1SLC22A1 | |
| SCHEMBL6979152 | 0.87 | CYP3A4 (0.48) | CCR8CYP2D6KDM4EALDH1A1SLC22A1 | |
| SCHEMBL6968777 | 0.87 | CYP2D6 (0.52) | CCR8CYP2D6KDM4EALDH1A1SLC22A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1051413-B1 | QUINOLINE DERIVATIVES AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2003-06-04 | — | — | EP | claimed |
| EP-1051413-B1 | QUINOLINE DERIVATIVES AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2003-06-04 | — | — | EP | disclosed |