Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.48 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.48 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 13/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2673559 | 0.74 | ALK (0.47) | S1PR1PDE3BPDE3AAURKBINCENP | |
| SCHEMBL2674208 | 0.73 | CYP2C9 (0.43) | S1PR1PDE3BPDE3AAURKBINCENP | |
| SCHEMBL6371741 | 0.73 | S1PR1 (0.39) | S1PR1PDE3BPDE3AAURKBINCENP | |
| SCHEMBL2673832 | 0.70 | KDM4E (0.41) | HSP90AA1HSP90AB1S1PR1PDE3BPDE3A | |
| SCHEMBL2674395 | 0.70 | S1PR1 (0.37) | HSP90AA1S1PR1PDE3BPDE3AAURKB | |
| SCHEMBL27659830 | 0.70 | JAK2 (0.40) | IDO1PARP1S1PR1PDE3BPDE3A | |
| SCHEMBL14142311 | 0.68 | S1PR1 (0.35) | S1PR1PDE3BPDE3AAURKBINCENP | |
| SCHEMBL2674216 | 0.68 | PDE3B (0.63) | S1PR1PDE3BPDE3AAURKBINCENP | |
| SCHEMBL2673409 | 0.68 | MKNK1 (0.40) | S1PR1PDE3BPDE3AAURKBINCENP | |
| SCHEMBL2674026 | 0.68 | DHODH (0.43) | PARP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1960975-A | Substituted pyridones as poly (ADP-ribose) polymerase (PARP) inhibitors | AVENTIS PHARMA INC (US) | 2007-05-09 | — | — | CN | claimed |
| CN-1960975-A | Substituted pyridones as poly (ADP-ribose) polymerase (PARP) inhibitors | AVENTIS PHARMA INC (US) | 2007-05-09 | — | — | CN | disclosed |