Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR8 | P51685 | 2/20 | 0.49 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6224107 | 1.00 | CCR8 (0.49) | CCR8SLC2A1HTR1AADRA1DADRA1A | |
| SCHEMBL6224111 | 1.00 | CCR8 (0.49) | CCR8SLC2A1HTR1AADRA1DADRA1A | |
| Oxalic Acid SCHEMBL6222719 | 0.98 | CCR8 (0.48) | CCR8SLC2A1HTR1AADRA1DADRA1A | |
| Oxalic Acid SCHEMBL6222717 | 0.98 | CCR8 (0.48) | CCR8SLC2A1HTR1AADRA1DADRA1A | |
| SCHEMBL6222721 | 0.92 | CCR8 (0.48) | CCR8SLC2A1HTR1AADRA1DADRA1A | |
| SCHEMBL6222506 | 0.86 | CCR8 (0.54) | CCR8SLC2A1HTR1AADRA1DADRA1A | |
| Trifluoroacetic Acid SCHEMBL7832819 | 0.86 | CCR8 (0.47) | CCR8SLC2A1HTR1AADRA1DADRA1A | |
| Oxalic Acid SCHEMBL6223378 | 0.86 | CCR8 (0.47) | CCR8SLC2A1HTR1AADRA1DADRA1A | |
| Oxalic Acid SCHEMBL6223377 | 0.86 | CCR8 (0.47) | CCR8SLC2A1HTR1AADRA1DADRA1A | |
| SCHEMBL6221361 | 0.84 | KCNH2 (0.40) | CCR8SLC2A1KCNH2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1121355-B1 | QUINOLINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS | SMITHKLINE BEECHAM PLC (GB) | 2005-12-14 | — | — | EP | claimed |
| US-6602882-B1 | Quinoline derivatives and their use as antibacterial agents | SMITHKLINE BEECHAM P.L.C. (GB) | 2003-08-05 | — | — | US | claimed |
| EP-1121355-A1 | QUINOLINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS | SMITHKLINE BEECHAM PLC (GB) | 2001-08-08 | — | — | EP | claimed |
| WO-2000021952-A1 | QUINOLINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS | SMITHKLINE BEECHAM PLC (GB) | 2000-04-20 | — | — | WO | claimed |