Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | SLC2A1 | P11166 | 12/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.31 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3686883 | 0.96 | KCNH2 (0.34) | KCNH2SLC2A1SIGMAR1 | |
| SCHEMBL5262026 | 0.89 | KCNH2 (0.32) | KCNH2 | |
| SCHEMBL3697776 | 0.88 | SLC2A1 (0.38) | KCNH2SLC2A1SIGMAR1ABCB1 | |
| SCHEMBL5255791 | 0.85 | KCNH2 (0.52) | KCNH2SLC2A1 | |
| SCHEMBL3695685 | 0.84 | DRD4 (0.30) | — | |
| SCHEMBL5254382 | 0.84 | KCNH2 (0.51) | KCNH2SLC2A1 | |
| SCHEMBL3775157 | 0.83 | KCNH2 (0.41) | KCNH2SLC2A1 | |
| SCHEMBL3694994 | 0.83 | — | — | |
| SCHEMBL3694128 | 0.82 | HTR1A (0.32) | — | |
| SCHEMBL5650870 | 0.81 | KCNH2 (0.49) | KCNH2SLC2A1 |
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-1359908-B1 | QUINOLINES AND NITROGENATED DERIVATIVES THEREOF SUBSTITUTED IN 4-POSITION BY A PIPERIDINE-CONTAINING MOIETY AND THEIR USE AS ANTIBACTERIAL AGENTS | SMITHKLINE BEECHAM PLC (GB) | 2007-08-22 | — | — | EP | claimed |