Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 18/20 | 0.61 |
| ▸ | ITGB1 | P05556 | 18/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | AKT1 | P31749 | 1/20 | 0.47 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
| ▸ | ITGAV | P06756 | 1/20 | 0.44 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4735439 | 0.93 | ITGA4 (0.65) | ITGA4ITGB1CYP3A4CYP2C9AKT1 | |
| SCHEMBL4730881 | 0.91 | ITGA4 (0.53) | ITGA4ITGB1CYP3A4CYP2C9AKT1 | |
| SCHEMBL4734486 | 0.91 | ITGB1 (0.62) | ITGA4ITGB1CYP3A4CYP2C9AKT1 | |
| SCHEMBL4734787 | 0.84 | ITGB1 (0.55) | ITGA4ITGB1CYP3A4CYP2C9AKT1 | |
| SCHEMBL4786565 | 0.83 | ITGA4 (0.58) | ITGA4ITGB1CYP3A4CYP2C9AKT1 | |
| SCHEMBL4736591 | 0.82 | ITGA4 (0.55) | ITGA4ITGB1ITGB7ITGB3ITGAV | |
| SCHEMBL4736233 | 0.78 | ITGA4 (0.53) | ITGA4ITGB1CYP3A4CYP2C9ITGB7 | |
| SCHEMBL4736103 | 0.77 | ITGA4 (0.62) | ITGA4ITGB1CYP3A4CYP2C9ITGB7 | |
| SCHEMBL4736084 | 0.77 | ITGA4 (0.62) | ITGA4ITGB1CYP3A4CYP2C9ITGB7 | |
| SCHEMBL4732547 | 0.77 | ITGA4 (0.62) | ITGA4ITGB1CYP3A4CYP2C9ITGB7 |
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-2008064823-A1 | BICYCLIC AND HETEROBICYCLIC DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES | UCB PHARMA, S.A. (BE) | 2008-06-05 | — | — | WO | claimed |
| WO-2008064823-A1 | BICYCLIC AND HETEROBICYCLIC DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES | UCB PHARMA, S.A. (BE) | 2008-06-05 | — | — | WO | disclosed |