Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR8 | P51685 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5757405 | 0.85 | SLC2A1 (0.59) | CCR8KCNH2HTR1ASIGMAR1KDM4E | |
| SCHEMBL5754347 | 0.84 | CCR8 (0.51) | CCR8KCNH2HTR1ASIGMAR1KDM4E | |
| SCHEMBL6988402 | 0.79 | CYP2D6 (0.44) | KCNH2KDM4EALDH1A1SLC2A1 | |
| SCHEMBL6985392 | 0.78 | NCF1 (0.58) | KCNH2HTR1AKDM4EALDH1A1 | |
| SCHEMBL7017484 | 0.76 | CYP2D6 (0.48) | KCNH2KDM4EALDH1A1SLC2A1 | |
| SCHEMBL6485488 | 0.74 | SLC2A1 (0.53) | KCNH2SLC2A1 | |
| SCHEMBL6485496 | 0.74 | SLC2A1 (0.53) | KCNH2SLC2A1 | |
| SCHEMBL6485492 | 0.74 | SLC2A1 (0.53) | KCNH2SLC2A1 | |
| SCHEMBL7732256 | 0.74 | KCNH2 (0.69) | KCNH2 | |
| SCHEMBL7732247 | 0.74 | KCNH2 (0.69) | KCNH2 |
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-1343765-A1 | QUINOLINES AND NITROGENATED DERIVATIVES THEREOF SUBSTITUTED IN 4-POSITION BY A PIPERAZINE-CONTAINING MOIETY AND THEIR USE AS ANTIBACTERIAL AGENTS | SMITHKLINE BEECHAM PLC (GB) | 2003-09-17 | — | — | EP | disclosed |
| WO-2002050040-A1 | QUINOLINES AND NITROGENATED DERIVATIVES THEREOF SUBSTITUTED IN 4-POSITION BY A PIPERAZINE-CONTAINING MOIETY AND THEIR USE AS ANTIBACTERIAL AGENTS | SMITHKLINE BEECHAM PLC (GB) | 2002-06-27 | — | — | WO | disclosed |