Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR8 | P51685 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 5/20 | 0.38 |
| ▸ | HTR1D | P28221 | 5/20 | 0.38 |
| ▸ | HTR1B | P28222 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6975728 | 0.89 | CCR8 (0.56) | CCR8KCNH2 | |
| SCHEMBL6969343 | 0.87 | CCR8 (0.42) | CCR8KCNH2CYP2D6HTR1AHTR1D | |
| SCHEMBL6970280 | 0.84 | CCR8 (0.44) | CCR8KCNH2CYP2D6HTR1AHTR1D | |
| SCHEMBL6974682 | 0.83 | CCR8 (0.43) | CCR8KCNH2HRH3CYP2D6HTR1A | |
| SCHEMBL6972423 | 0.83 | CCR8 (0.43) | CCR8KCNH2HRH3CYP2D6HTR1A | |
| SCHEMBL6968017 | 0.81 | CCR8 (0.44) | CCR8KCNH2HRH3CYP2D6HTR1A | |
| SCHEMBL6966012 | 0.79 | CCR8 (0.42) | CCR8KCNH2CYP2D6HTR1AKDM4E | |
| SCHEMBL6626735 | 0.78 | CCR8 (0.54) | CCR8KCNH2HTR1A | |
| SCHEMBL6971729 | 0.76 | CCR8 (0.52) | CCR8KCNH2CYP2D6HTR1AKDM4E | |
| SCHEMBL6978601 | 0.76 | CCR8 (0.39) | CCR8KCNH2CYP2D6KDM4ECYP3A4 |
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-A1 | QUINOLINE DERIVATIVES AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2000-11-15 | — | — | EP | claimed |
| WO-1999037635-A1 | QUINOLINE DERIVATIVES AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 1999-07-29 | — | — | WO | claimed |