Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 3/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.37 |
| ▸ | PSMB2 | P49721 | 6/20 | 0.37 |
| ▸ | PSMB5 | P28074 | 6/20 | 0.37 |
| ▸ | PSMB1 | P20618 | 5/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
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 | 0.71 | TNF (0.53) | TNFMTNR1BPSMB2PSMB5PSMB1 | |
| SCHEMBL19675236 | 0.70 | TNF (0.49) | TNFPSMB2PSMB5PSMB1MCL1 | |
| SCHEMBL28039279 | 0.70 | TNF (0.49) | TNFPSMB2PSMB5PSMB1MCL1 | |
| SCHEMBL3949243 | 0.68 | TNF (0.64) | TNFPSMB2PSMB5PSMB1 | |
| SCHEMBL27751211 | 0.68 | ALDH1A1 (0.50) | MCL1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL15595910 | 0.67 | KDM4E (0.38) | SUV39H2 | |
| SCHEMBL31207123 | 0.67 | ALDH1A1 (0.43) | TNFMCL1PDE4APDE4BPDE4C | |
| SCHEMBL15216009 | 0.66 | IDO1 (0.44) | TNFSUV39H2PSMB2PSMB5PSMB1 | |
| SCHEMBL3951034 | 0.66 | ROCK1 (0.46) | MCL1 | |
| SCHEMBL7413595 | 0.65 | MAPT (0.40) | TNFTDP1PDE4APDE4BPDE4C |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0120637-B1 | BENZOQUINOLIZINES | JOHN WYETH & BROTHER LIMITED (GB) | 1988-01-20 | — | — | EP | disclosed |
| US-4526967-A | Benzoquinolizines and use as α2 -adrenoceptor antagonistics | JOHN WYETH & BROTHER LIMITED (GB) | 1985-07-02 | — | — | US | disclosed |
| WO-1984003702-A1 | BENZOQUINOLIZINES | WYETH JOHN & BROTHER LTD (GB) | 1984-09-27 | — | — | WO | disclosed |