Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 18/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 18/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8361449 | 1.00 | ITGB1 (0.42) | ITGB1ITGA4MEN1KMT2A | |
| SCHEMBL4678413 | 0.93 | ITGB1 (0.47) | ITGB1ITGA4 | |
| SCHEMBL8358419 | 0.93 | ITGB1 (0.47) | ITGB1ITGA4 | |
| Hydrochloric Acid SCHEMBL4674432 | 0.93 | ITGB1 (0.47) | ITGB1ITGA4 | |
| Hydrochloric Acid SCHEMBL4674425 | 0.93 | ITGB1 (0.47) | ITGB1ITGA4 | |
| Hydrochloric Acid SCHEMBL4674418 | 0.93 | ITGB1 (0.47) | ITGB1ITGA4 | |
| SCHEMBL8358384 | 0.92 | ITGA4 (0.41) | ITGB1ITGA4MEN1KMT2A | |
| SCHEMBL4675188 | 0.92 | ITGA4 (0.41) | ITGB1ITGA4MEN1KMT2A | |
| SCHEMBL4671417 | 0.91 | ITGA4 (0.40) | ITGB1ITGA4MEN1KMT2A | |
| SCHEMBL8361037 | 0.91 | ITGA4 (0.40) | ITGB1ITGA4MEN1KMT2A |
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-1414444-B1 | NOVEL IMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS VLA-4 ANTAGONISTS | SANOFI AVENTIS DEUTSCHLAND (DE) | 2008-04-09 | — | — | EP | disclosed |
| EP-1414444-A1 | NOVEL IMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS VLA-4 ANTAGONISTS | Aventis Pharma Deutschland GmbH (DE) | 2004-05-06 | — | — | EP | disclosed |
| WO-2003011288-A1 | NOVEL IMIDAZOLIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS VLA-4 ANTAGONISTS | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2003-02-13 | — | — | WO | disclosed |