Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAV | P06756 | 18/20 | 0.43 |
| ▸ | ITGB3 | P05106 | 18/20 | 0.43 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.38 |
| ▸ | MME | P08473 | 1/20 | 0.37 |
| ▸ | ACE | P12821 | 1/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13170299 | 0.82 | ACE (0.46) | ITGAVITGB3ITGB6MMEACE | |
| SCHEMBL7539260 | 0.80 | ITGB1 (0.45) | ITGAVITGB3ITGA2B | |
| SCHEMBL7241839 | 0.69 | ITGB3 (0.51) | ITGAVITGB3ITGA2B | |
| SCHEMBL8657006 | 0.67 | ACE (0.60) | ITGAVITGB3MMEACEITGA2B | |
| SCHEMBL11032508 | 0.67 | ACE (0.60) | ITGAVITGB3MMEACEITGA2B | |
| SCHEMBL1712913 | 0.66 | ACE (0.53) | ITGAVITGB3MMEACEITGA2B | |
| SCHEMBL1712911 | 0.66 | ACE (0.53) | ITGAVITGB3MMEACEITGA2B | |
| SCHEMBL7242454 | 0.65 | ITGB3 (0.57) | ITGAVITGB3ITGA2B | |
| SCHEMBL30171991 | 0.64 | CXCR4 (0.45) | ITGAVITGB3ITGB6ITGA2B | |
| SCHEMBL14598327 | 0.63 | CTSS (0.56) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1208088-A2 | FLUORENE DERIVATIVES AS INTEGRIN INHIBITORS | MERCK PATENT GmbH (DE) | 2002-05-29 | — | — | EP | claimed |
| WO-2001010841-A2 | FLUORENE DERIVATIVES AS INTEGRIN INHIBITORS | MERCK PATENT GMBH (DE) | 2001-02-15 | — | — | WO | claimed |
| EP-1208088-A2 | FLUORENE DERIVATIVES AS INTEGRIN INHIBITORS | MERCK PATENT GmbH (DE) | 2002-05-29 | — | — | EP | disclosed |
| WO-2001010841-A2 | FLUORENE DERIVATIVES AS INTEGRIN INHIBITORS | MERCK PATENT GMBH (DE) | 2001-02-15 | — | — | WO | disclosed |