Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 10/20 | 0.40 |
| ▸ | HTR1D | P28221 | 7/20 | 0.40 |
| ▸ | HTR1B | P28222 | 7/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 3/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL14573146 | 0.88 | KCNH2 (0.49) | HTR1AHTR1DHTR1BKCNH2SLC6A4 | |
| SCHEMBL14573145 | 0.85 | KCNH2 (0.48) | HTR1AKCNH2SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL5764950 | 0.79 | HTR1A (0.51) | HTR1AHTR1DHTR1BKCNH2SLC6A4 | |
| SCHEMBL5763984 | 0.77 | KCNH2 (0.45) | HTR1AKCNH2SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL14573160 | 0.76 | KCNH2 (0.48) | KCNH2TRPV1 | |
| SCHEMBL14573144 | 0.76 | KCNH2 (0.61) | KCNH2 | |
| SCHEMBL14573143 | 0.76 | KCNH2 (0.55) | KCNH2 | |
| SCHEMBL6667458 | 0.76 | KCNH2 (0.45) | KCNH2 | |
| SCHEMBL6666169 | 0.76 | KCNH2 (0.49) | HTR1AKCNH2SLC6A4 | |
| SCHEMBL14573142 | 0.76 | 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 |