Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 13/20 | 0.51 |
| ▸ | HTR1D | P28221 | 9/20 | 0.51 |
| ▸ | HTR1B | P28222 | 7/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.47 |
| ▸ | DRD2 | P14416 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | HTR2B | P41595 | 2/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14573146 | 0.90 | KCNH2 (0.49) | HTR1AHTR1DHTR1BSLC6A4KCNH2 | |
| SCHEMBL5764977 | 0.88 | HTR1D (0.53) | HTR1AHTR1DHTR1BKCNH2 | |
| SCHEMBL5765233 | 0.86 | SLC2A1 (0.43) | HTR1AHTR1DKCNH2 | |
| SCHEMBL5764668 | 0.86 | KCNH2 (0.53) | KCNH2 | |
| SCHEMBL5764517 | 0.86 | KCNH2 (0.58) | KCNH2 | |
| SCHEMBL5764669 | 0.86 | KCNH2 (0.45) | KCNH2 | |
| SCHEMBL5764847 | 0.83 | KCNH2 (0.48) | KCNH2 | |
| SCHEMBL5765881 | 0.83 | KCNH2 (0.45) | KCNH2 | |
| SCHEMBL5763984 | 0.82 | KCNH2 (0.45) | HTR1ASLC6A4KCNH2 | |
| SCHEMBL6684945 | 0.79 | HTR1A (0.40) | HTR1AHTR1DHTR1BSLC6A4KCNH2 |
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-1392686-B1 | BICYCLIC NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVES FOR USE AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2006-10-18 | — | — | EP | claimed |