Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.45 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.45 |
| ▸ | ULK1 | O75385 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL6187035 | 0.89 | PARP1 (0.48) | PARP1PARP15PARP10ULK1ALDH1A1 | |
| SCHEMBL6190881 | 0.88 | PARP1 (0.47) | PARP1PARP15PARP10ULK1TP53 | |
| SCHEMBL6187015 | 0.88 | ULK1 (0.49) | ULK1HTR1AHTR1DHTR1BHTR2C | |
| SCHEMBL6185392 | 0.88 | MAOA (0.49) | ULK1HTR1AHTR1DHTR1BHTR2C | |
| SCHEMBL6188508 | 0.87 | MAOA (0.51) | ULK1POLBALDH1A1MTNR1AMTNR1B | |
| SCHEMBL6185141 | 0.84 | PARP1 (0.44) | PARP1PARP15PARP10POLBMALT1 | |
| SCHEMBL6187011 | 0.84 | PARP1 (0.42) | PARP1PARP15PARP10ULK1MALT1 | |
| SCHEMBL6188504 | 0.79 | GRM4 (0.51) | ULK1HTR1AHTR1DHTR1BHTR2C | |
| SCHEMBL6188460 | 0.77 | MAOA (0.46) | ULK1TP53HPGDMAPTLMNA | |
| SCHEMBL6189327 | 0.76 | HPGD (0.46) | ULK1ALDH1A1TP53HPGDMAPT |
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 |