Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.55 |
| ▸ | PDE7A | Q13946 | 9/20 | 0.53 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.50 |
| ▸ | PDE7B | Q9NP56 | 3/20 | 0.49 |
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | USP7 | Q93009 | 1/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL8098834 | 0.85 | PDE7A (0.64) | PDE7AVCAM1PDE7BCA2CA12 | |
| SCHEMBL8091331 | 0.81 | CA1 (0.49) | PDE7ACA2CA12CA1CA9 | |
| SCHEMBL28267868 | 0.79 | PDE7A (0.66) | IDO1PDE7APDE7BUSP7ALDH1A1 | |
| SCHEMBL8107806 | 0.79 | VCAM1 (0.56) | PDE7AVCAM1PDE7BCA2CA12 | |
| SCHEMBL8105352 | 0.77 | CA2 (0.51) | PDE7AVCAM1PDE7BCA2CA12 | |
| SCHEMBL8107618 | 0.75 | NR3C1 (0.42) | CA2CA12CA1CA9KMT2A | |
| SCHEMBL28405 | 0.75 | PDE7A (0.77) | IDO1PDE7APDE7BALDH1A1KMT2A | |
| SCHEMBL8104943 | 0.74 | CA2 (0.48) | PDE7AVCAM1CA2CA12CA1 | |
| SCHEMBL5955531 | 0.72 | CCR2 (0.47) | IDO1PDE7APDE7BUSP7ALDH1A1 | |
| SCHEMBL15307419 | 0.72 | PDE7A (0.64) | IDO1PDE7APDE7BUSP7ALDH1A1 |
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-0848703-B1 | DERIVATIVES OF BENZOSULPHONAMIDES AS INHIBITORS OF THE ENZYME CYCLO-OXYGENASE II | NYCOMED AUSTRIA GMBH (AT) | 2000-09-27 | — | — | EP | disclosed |
| US-6004948-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS; SIDE EFFECT REDUCTION | NYCOMED AUSTRIA GMBH (AT) | 1999-12-21 | — | — | US | disclosed |