Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 5/20 | 0.49 |
| ▸ | PSMB2 | P49721 | 7/20 | 0.43 |
| ▸ | PSMB5 | P28074 | 7/20 | 0.43 |
| ▸ | PSMB1 | P20618 | 6/20 | 0.43 |
| ▸ | MPO | P05164 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16328854 | 0.81 | TNF (0.53) | TNFPSMB2PSMB5PSMB1TDP1 | |
| SCHEMBL28039279 | 0.79 | TNF (0.49) | TNFPSMB2PSMB5PSMB1TDP1 | |
| SCHEMBL19675649 | 0.78 | KDM4E (0.48) | KDM4EALDH1A1MAPTHPGDGAA | |
| SCHEMBL3949243 | 0.77 | TNF (0.64) | TNFPSMB2PSMB5PSMB1KDM4E | |
| SCHEMBL28022549 | 0.72 | MPO (0.39) | MPOXDHKDM4EALDH1A1MAPT | |
| SCHEMBL14149433 | 0.71 | TNF (0.48) | TNFPSMB2PSMB5PSMB1TDP1 | |
| SCHEMBL14106255 | 0.70 | TNF (0.47) | TNFPSMB2PSMB5PSMB1MAPT | |
| SCHEMBL10651277 | 0.70 | TNF (0.41) | TNFPSMB2PSMB5PSMB1TDP1 | |
| SCHEMBL27751211 | 0.70 | ALDH1A1 (0.50) | KDM4EALDH1A1MAPTHPGDGAA | |
| SCHEMBL6189209 | 0.69 | TNF (0.52) | TNFPSMB2PSMB5PSMB1 |
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-3252050-A1 | PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS | Bristol-Myers Squibb Company (US) | 2017-12-06 | — | — | EP | disclosed |
| EP-3252049-A1 | PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS | Bristol-Myers Squibb Company (US) | 2017-12-06 | — | — | EP | disclosed |