Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 4/20 | 0.44 |
| ▸ | HTR1D | P28221 | 13/20 | 0.43 |
| ▸ | HTR1B | P28222 | 12/20 | 0.43 |
| ▸ | HTR1A | P08908 | 3/20 | 0.43 |
| ▸ | IKBKB | O14920 | 1/20 | 0.43 |
| ▸ | CHUK | O15111 | 1/20 | 0.43 |
| ▸ | HTR1F | P30939 | 2/20 | 0.41 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL551703 | 0.83 | IKBKB (0.67) | IKBKBCHUK | |
| Trifluoroacetic Acid SCHEMBL553173 | 0.80 | IKBKB (0.64) | IKBKBCHUK | |
| SCHEMBL552131 | 0.73 | IKBKB (0.69) | IKBKBCHUK | |
| SCHEMBL552533 | 0.72 | IKBKB (0.68) | IKBKBCHUK | |
| Trifluoroacetic Acid SCHEMBL553234 | 0.71 | IKBKB (0.64) | IKBKBCHUK | |
| Trifluoroacetic Acid SCHEMBL552304 | 0.70 | IKBKB (0.64) | IKBKBCHUK | |
| SCHEMBL551383 | 0.67 | IKBKB (0.70) | IKBKBCHUK | |
| SCHEMBL553385 | 0.67 | IKBKB (0.73) | IKBKBCHUK | |
| SCHEMBL552578 | 0.66 | IKBKB (0.68) | IKBKBCHUK | |
| SCHEMBL553121 | 0.66 | IKBKB (0.71) | IKBKBCHUK |
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-1896014-A2 | CHEMICAL COMPOUNDS | Smithkline Beecham Corporation (US) | 2008-03-12 | — | — | EP | claimed |
| WO-2007005534-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-01-11 | — | — | WO | claimed |