Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 17/20 | 0.69 |
| ▸ | ITGA2B | P08514 | 17/20 | 0.69 |
| ▸ | ITGAV | P06756 | 1/20 | 0.60 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.60 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.43 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7348077 | 0.88 | ITGB3 (0.54) | ITGB3ITGA2BITGAVCHRM2SLC6A4 | |
| SCHEMBL8724698 | 0.87 | ITGB3 (0.78) | ITGB3ITGA2BITGAVCHRM2SLC6A4 | |
| SCHEMBL8720937 | 0.84 | ITGB3 (0.92) | ITGB3ITGA2BITGAVCHRM2SLC6A4 | |
| SCHEMBL8720908 | 0.83 | ITGB3 (0.98) | ITGB3ITGA2BITGAVCHRM2SLC6A4 | |
| Trifluoroacetic Acid SCHEMBL7409565 | 0.83 | ITGB3 (0.66) | ITGB3ITGA2BITGAVCHRM2SLC6A4 | |
| SCHEMBL7443090 | 0.82 | ITGB3 (1.00) | ITGB3ITGA2BITGAVCHRM2SLC6A4 | |
| Hydrochloric Acid SCHEMBL7274636 | 0.81 | ITGB3 (0.98) | ITGB3ITGA2BITGAVCHRM2SLC6A4 | |
| SCHEMBL28741076 | 0.81 | ITGB3 (0.75) | ITGB3ITGA2BITGAVCHRM2SLC6A4 | |
| SCHEMBL8720431 | 0.80 | ITGB3 (0.92) | ITGB3ITGA2BITGAVCHRM2SLC6A4 | |
| SCHEMBL28935734 | 0.80 | ITGB3 (0.77) | ITGB3ITGA2BITGAVCHRM2SLC6A4 |
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-0907637-A1 | PHENYLALAMINE DERIVATIVES AS INTEGRIN INHIBITORS | MERCK PATENT GmbH (DE) | 1999-04-14 | — | — | EP | disclosed |
| WO-1998000395-A1 | PHENYLALAMINE DERIVATIVES AS INTEGRIN INHIBITORS | MERCK PATENT GMBH (DE) | 1998-01-08 | — | — | WO | disclosed |