Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.59 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.58 |
| ▸ | RET | P07949 | 7/20 | 0.57 |
| ▸ | ABL1 | P00519 | 2/20 | 0.57 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | PDE5A | O76074 | 1/20 | 0.56 |
| ▸ | PDE1A | P54750 | 1/20 | 0.56 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.56 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | MPI | P34949 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL13914725 | 0.91 | RET (0.69) | SIRT1ADORA1RETABL1ALK | |
| SCHEMBL13913812 | 0.90 | RET (0.68) | SIRT1ADORA1RETABL1ALK | |
| SCHEMBL13914591 | 0.90 | SIRT1 (0.58) | SIRT1ADORA1RETABL1ALK | |
| SCHEMBL13914611 | 0.88 | RET (0.70) | SIRT1ADORA1RETABL1ALK | |
| SCHEMBL13913710 | 0.87 | RET (0.73) | SIRT1ADORA1RETABL1ALK | |
| SCHEMBL13913533 | 0.87 | SIRT1 (0.76) | SIRT1ADORA1RETABL1ALK | |
| SCHEMBL13913680 | 0.86 | PDE5A (0.73) | SIRT1ADORA1RETABL1ALK | |
| SCHEMBL13913624 | 0.86 | RET (0.73) | SIRT1ADORA1RETABL1ALK | |
| SCHEMBL13913805 | 0.85 | ADORA1 (0.66) | SIRT1ADORA1ALDH1A1MEN1KMT2A | |
| SCHEMBL13914592 | 0.84 | RET (0.55) | SIRT1ADORA1RETABL1ALK |
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 |
|---|---|---|---|---|---|---|---|
| US-7504421-B2 | Substituted 2-thio-3,5-dicyano-4-aryl-6-aminopyridines and their use | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-03-17 | — | — | US | disclosed |