Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRPF1 | P55201 | 2/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | FNTA | P49354 | 1/20 | 0.37 |
| ▸ | FNTB | P49356 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.37 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.37 |
| ▸ | GSK3A | P49840 | 1/20 | 0.37 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.37 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6479624 | 0.86 | BRPF1 (0.43) | BRPF1HCRTR1HCRTR2AKR1C3AKR1C2 | |
| SCHEMBL6480163 | 0.78 | AKR1C3 (0.44) | BRPF1AKR1C3AKR1C2TUBB1ALDH1A1 | |
| SCHEMBL6489065 | 0.78 | AKR1C3 (0.39) | BRPF1HCRTR1HCRTR2AKR1C3AKR1C2 | |
| SCHEMBL6490788 | 0.76 | TUBB1 (0.50) | BRPF1HCRTR1HCRTR2AKR1C3AKR1C2 | |
| SCHEMBL6749324 | 0.76 | BRPF1 (0.46) | BRPF1AKR1C3AKR1C2TUBB1ALDH1A1 | |
| SCHEMBL6494742 | 0.74 | AKR1C3 (0.40) | AKR1C3AKR1C2NPC1RAB9APDE2A | |
| SCHEMBL6229626 | 0.73 | AKR1C3 (0.50) | BRPF1AKR1C3AKR1C2TUBB1ALDH1A1 | |
| SCHEMBL1617658 | 0.73 | BRPF1 (0.43) | BRPF1AKR1C3AKR1C2TUBB1ALDH1A1 | |
| SCHEMBL5436506 | 0.69 | NR1H2 (0.44) | BRPF1AKR1C3AKR1C2TUBB1CHEK1 | |
| SCHEMBL5107559 | 0.69 | P2RX4 (0.41) | BRPF1AKR1C3AKR1C2TUBB1ALDH1A1 |
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-1554271-A1 | SUBSTITUTED INDOLES AND THEIR USE AS HCV INHIBITORS | Rigel Pharmaceuticals, Inc. (US) | 2005-07-20 | — | — | EP | disclosed |
| WO-2004035571-A1 | SUBSTITUTED INDOLES AND THEIR USE AS HCV INHIBITORS | RIGEL PHARMACEUTICALS, INC. (US) | 2004-04-29 | — | — | WO | disclosed |