Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.30 |
| ▸ | MCHR2 | Q969V1 | 1/20 | 0.30 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.30 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL6666166 | 0.84 | KCNH2 (0.39) | HTR1ASLC6A4KCNH2 | |
| SCHEMBL6661599 | 0.79 | SLC2A1 (0.36) | KCNH2 | |
| SCHEMBL6669040 | 0.78 | KCNH2 (0.45) | KCNH2 | |
| SCHEMBL6664492 | 0.76 | KCNH2 (0.41) | HTR1ASLC6A2SLC6A3KCNH2 | |
| SCHEMBL6669762 | 0.73 | ALDH1A1 (0.40) | KCNH2KMT2A | |
| SCHEMBL14573151 | 0.72 | KCNH2 (0.47) | KCNH2 | |
| SCHEMBL5657364 | 0.68 | HTR1A (0.49) | HTR1ASLC6A2SLC6A3SLC6A4KCNH2 | |
| SCHEMBL5765881 | 0.67 | KCNH2 (0.45) | KCNH2 | |
| SCHEMBL6666267 | 0.66 | MEN1 (0.37) | HTR1AKMT2A | |
| SCHEMBL6667354 | 0.63 | KCNH2 (0.44) | 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-1392686-A1 | BICYCLIC NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVES FOR USE AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2004-03-03 | — | — | EP | claimed |
| WO-2002096907-A1 | BICYCLIC NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVES FOR USE AS ANTIBACTERIALS | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-12-05 | — | — | WO | claimed |