Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.48 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.48 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | ULK1 | O75385 | 3/20 | 0.39 |
| ▸ | STK17B | O94768 | 2/20 | 0.38 |
| ▸ | STK17A | Q9UEE5 | 2/20 | 0.38 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.38 |
| ▸ | DAPK1 | P53355 | 1/20 | 0.38 |
| ▸ | DAPK2 | Q9UIK4 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6190881 | 0.91 | PARP1 (0.47) | PARP1PARP15PARP10MAOAMAOB | |
| SCHEMBL6189495 | 0.89 | PARP1 (0.45) | PARP1PARP15PARP10MAOAMAOB | |
| SCHEMBL6188460 | 0.89 | MAOA (0.46) | MAOAMAOBMAPTTP53ULK1 | |
| SCHEMBL6185141 | 0.87 | PARP1 (0.44) | PARP1PARP15PARP10MAOAMAOB | |
| SCHEMBL6187132 | 0.87 | MAOA (0.50) | MAOAMAOBMAPTTP53ULK1 | |
| SCHEMBL6189454 | 0.87 | MAOA (0.53) | MAOAMAOBMAPTTP53ULK1 | |
| SCHEMBL6188606 | 0.86 | MAOA (0.55) | MAOAMAOBMAPTTP53STK17B | |
| SCHEMBL6187011 | 0.85 | PARP1 (0.42) | PARP1PARP15PARP10MAOAMAOB | |
| SCHEMBL6189327 | 0.79 | HPGD (0.46) | MAOAMAOBMAPTTP53ULK1 | |
| SCHEMBL6184788 | 0.79 | MAOA (0.45) | MAOAMAOBMAPTULK1STK17B |
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 |