Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 14/20 | 0.67 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | PGR | P06401 | 1/20 | 0.50 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL4765533 | 0.94 | HRH3 (0.61) | HRH3NPC1TP53GAANFKB1 | |
| SCHEMBL4770633 | 0.92 | HRH3 (0.64) | HRH3NPC1TP53GAANFKB1 | |
| SCHEMBL4768623 | 0.88 | RAB9A (0.58) | HRH3NPC1TP53GAANFKB1 | |
| SCHEMBL4771074 | 0.87 | HRH3 (0.64) | HRH3NPC1TP53NFKB1RAB9A | |
| Trifluoroacetic Acid SCHEMBL4770267 | 0.87 | HRH3 (0.57) | HRH3NPC1TP53GAANFKB1 | |
| SCHEMBL4777053 | 0.86 | HRH3 (0.57) | HRH3NPC1TP53GAANFKB1 | |
| SCHEMBL4774628 | 0.85 | TMPRSS2 (0.61) | HRH3NPC1TP53GAANFKB1 | |
| SCHEMBL4768058 | 0.84 | NPC1 (0.69) | HRH3NPC1TP53GAANFKB1 | |
| SCHEMBL4765225 | 0.84 | HRH3 (0.55) | HRH3NPC1TP53GAANFKB1 | |
| SCHEMBL4765905 | 0.84 | NPC1 (0.69) | HRH3NPC1TP53GAANFKB1 |
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-1713778-B1 | BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS | GLAXO GROUP LTD (GB) | 2008-01-16 | — | — | EP | claimed |