Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2859872 | 0.92 | TAAR1 (0.54) | NPC1RAB9AHPGDTAAR1GAA | |
| SCHEMBL2854887 | 0.92 | HPGD (0.49) | NPC1RAB9AHPGDNR3C1 | |
| SCHEMBL2853389 | 0.91 | NPC1 (0.62) | NPC1RAB9ATAAR1GAATP53 | |
| SCHEMBL2861261 | 0.88 | HPGD (0.64) | NPC1RAB9AHPGDGAAMAPK1 | |
| SCHEMBL2861634 | 0.87 | RAB9A (0.44) | NPC1RAB9AHPGDTAAR1TP53 | |
| SCHEMBL2857468 | 0.86 | MAPT (0.47) | NPC1RAB9AHPGDTP53L3MBTL1 | |
| SCHEMBL2856602 | 0.85 | RIPK1 (0.46) | HPGDTP53MAPK1MAPT | |
| SCHEMBL2856862 | 0.84 | NPC1 (0.53) | NPC1RAB9ATAAR1GAAMAPT | |
| SCHEMBL2857276 | 0.84 | RAB9A (0.47) | NPC1RAB9AHPGDTP53MAPK1 | |
| SCHEMBL2854509 | 0.83 | KDM4E (0.50) | NPC1RAB9ATAAR1GAATP53 |
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-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |