Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 10/20 | 0.51 |
| ▸ | ITGAV | P06756 | 5/20 | 0.51 |
| ▸ | F10 | P00742 | 1/20 | 0.49 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 7/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 4/20 | 0.42 |
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | CA5A | P35218 | 4/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7455523 | 1.00 | ITGB3 (0.51) | ITGB3ITGAVF10MMP1MMP2 | |
| SCHEMBL7455657 | 0.98 | ITGB3 (0.52) | ITGB3ITGAVF10MMP1MMP2 | |
| SCHEMBL7455662 | 0.98 | ITGB3 (0.52) | ITGB3ITGAVF10MMP1MMP2 | |
| SCHEMBL7457575 | 0.92 | F10 (0.47) | ITGB3ITGAVF10MMP1MMP2 | |
| SCHEMBL7465932 | 0.91 | F10 (0.48) | ITGB3ITGAVF10MMP1MMP2 | |
| SCHEMBL7462968 | 0.91 | F10 (0.48) | ITGB3ITGAVF10MMP1MMP2 | |
| SCHEMBL7456479 | 0.90 | F10 (0.47) | ITGB3ITGAVF10MMP1MMP2 | |
| SCHEMBL7698171 | 0.89 | ITGB3 (0.53) | ITGB3ITGAVF10MMP1MMP2 | |
| SCHEMBL7694499 | 0.89 | ITGB3 (0.53) | ITGB3ITGAVF10MMP1MMP2 | |
| SCHEMBL7462028 | 0.88 | ITGB3 (0.56) | ITGB3ITGAVF10MMP1MMP2 |
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 |