Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 9/20 | 0.44 |
| ▸ | SLC2A1 | P11166 | 4/20 | 0.40 |
| ▸ | PREP | P48147 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5262741 | 0.86 | KCNH2 (0.45) | KCNH2SLC2A1 | |
| SCHEMBL3687241 | 0.79 | KCNH2 (0.44) | KCNH2SLC2A1 | |
| SCHEMBL3689450 | 0.76 | SLC2A1 (0.47) | KCNH2SLC2A1 | |
| SCHEMBL3695637 | 0.74 | MTNR1B (0.40) | KCNH2SLC2A1MCHR1 | |
| SCHEMBL3688036 | 0.72 | SLC2A1 (0.46) | KCNH2SLC2A1 | |
| SCHEMBL5316419 | 0.70 | KCNH2 (0.36) | KCNH2SLC2A1 | |
| SCHEMBL3771621 | 0.70 | SLC2A1 (0.47) | KCNH2SLC2A1 | |
| SCHEMBL3920901 | 0.68 | CCR8 (0.61) | KCNH2 | |
| SCHEMBL5262592 | 0.67 | SLC2A1 (0.37) | KCNH2SLC2A1 | |
| SCHEMBL3690361 | 0.67 | SLC2A1 (0.39) | KCNH2SLC2A1MCHR1 |
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-1399443-B1 | NITROGEN-CONTAINING BICYCLIC HETEROCYCLES FOR USE AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2007-12-12 | — | — | EP | claimed |