Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ULK1 | O75385 | 4/20 | 0.49 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.49 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | ITK | Q08881 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR1B | P28222 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | STK17B | O94768 | 1/20 | 0.42 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6185392 | 0.98 | MAOA (0.49) | ULK1MTNR1AMTNR1BPOLBMAOA | |
| SCHEMBL6188508 | 0.97 | MAOA (0.51) | ULK1MTNR1AMTNR1BPOLBMAOA | |
| SCHEMBL6188504 | 0.88 | GRM4 (0.51) | ULK1MTNR1AMTNR1BPOLBMAOA | |
| SCHEMBL6189495 | 0.88 | PARP1 (0.45) | ULK1MTNR1AMTNR1BPOLBMAOA | |
| SCHEMBL6187132 | 0.88 | MAOA (0.50) | ULK1POLBMAOAMAOBNPSR1 | |
| SCHEMBL6186285 | 0.87 | MAOA (0.49) | ULK1POLBMAOAMAOBNPSR1 | |
| SCHEMBL6189884 | 0.86 | MAOA (0.48) | ULK1POLBMAOAMAOBNPSR1 | |
| SCHEMBL6189454 | 0.85 | MAOA (0.53) | ULK1POLBMAOAMAOBNPSR1 | |
| SCHEMBL6188606 | 0.85 | MAOA (0.55) | MAOAMAOBNPSR1ITKSMN1; SMN2 | |
| SCHEMBL6185134 | 0.84 | MAOA (0.54) | MAOAMAOBNPSR1GRM4ITK |
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 |