Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | HTR1D | P28221 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.45 |
| ▸ | CHRNG | P07510 | 1/20 | 0.45 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.45 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | CHRND | Q07001 | 1/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL17206662 | 0.87 | KCNQ2 (0.50) | NPC1RAB9AKCNQ2HTTFAAH | |
| SCHEMBL8655841 | 0.80 | HTR1A (0.52) | HTR1AHTR1DHTR2BKMT2ADPP7 | |
| SCHEMBL14683141 | 0.77 | NPC1 (0.48) | NPC1RAB9AKCNQ2HTTFAAH | |
| SCHEMBL8995900 | 0.77 | HTR1A (0.68) | KCNQ2HTR1AHTR1DHTR2BROCK2 | |
| SCHEMBL14683136 | 0.76 | KCNQ2 (0.48) | NPC1RAB9AKCNQ2HTTCHRNA1 | |
| SCHEMBL8995907 | 0.75 | HPGD (0.56) | NPC1RAB9AHTTL3MBTL1MEN1 | |
| SCHEMBL10823286 | 0.75 | NPC1 (0.48) | NPC1RAB9AKCNQ2HTTFAAH | |
| SCHEMBL16825159 | 0.74 | NPC1 (0.53) | NPC1RAB9AKCNQ2HTTFAAH | |
| SCHEMBL17206886 | 0.73 | TSHR (0.45) | HTTHTR1AHTR1DHTR2BSLC6A2 | |
| SCHEMBL13979987 | 0.73 | NPC1 (0.52) | NPC1RAB9AHTTFAAHCHRNA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5541179-A | Tropon-2-one piperazine carboxamides as serotonergic agents | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-07-30 | — | — | US | disclosed |