Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 5/20 | 0.34 |
| ▸ | AGXT | P21549 | 1/20 | 0.34 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.32 |
| ▸ | METAP2 | P50579 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | CETP | P11597 | 2/20 | 0.31 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.31 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.31 |
| ▸ | CFTR | P13569 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | SYK | P43405 | 1/20 | 0.30 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.30 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.30 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5134689 | 0.80 | RORC (0.35) | RORCAGXTALKBH1LCKKDR | |
| SCHEMBL4901550 | 0.79 | RORC (0.35) | RORCAGXTMETAP2KDM5BCFTR | |
| SCHEMBL4893446 | 0.68 | KDM4E (0.37) | RORCAGXTKDM5BCFTRNPSR1 | |
| SCHEMBL4895781 | 0.67 | KDM4E (0.38) | RORCAGXTKDM5BCFTRNPSR1 | |
| SCHEMBL5141914 | 0.67 | AGXT (0.39) | RORCAGXTDHFRAOC3SLC16A3 | |
| SCHEMBL4903611 | 0.67 | KDM4E (0.36) | AGXTKDM5BCFTRNPSR1SMN1; SMN2 | |
| SCHEMBL4282621 | 0.65 | AGXT (0.36) | AGXTAOC3SLC16A3SLC16A1MCTS1 | |
| SCHEMBL4901484 | 0.64 | PDE5A (0.42) | ALDH1A1 | |
| SCHEMBL4903686 | 0.63 | KDM4E (0.37) | AGXTKDM5BAOC3CFTRNPSR1 | |
| SCHEMBL22242840 | 0.63 | AGXT (0.57) | RORCAGXTAOC3ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008071650-A2 | NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES | GALAPAGOS N.V. (BE) | 2008-06-19 | — | — | WO | claimed |
| WO-2008071650-A2 | NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES | GALAPAGOS N.V. (BE) | 2008-06-19 | — | — | WO | disclosed |