Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | ITGB3 | P05106 | 6/20 | 0.46 |
| ▸ | ITGAV | P06756 | 6/20 | 0.46 |
| ▸ | NAMPT | P43490 | 6/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL7785616 | 0.92 | NAMPT (0.49) | ITGB3ITGAVNAMPT | |
| SCHEMBL7790192 | 0.81 | NAMPT (0.58) | HTTITGB3ITGAVNAMPT | |
| SCHEMBL7785608 | 0.73 | NAMPT (0.57) | ITGB3ITGAVNAMPT | |
| SCHEMBL4955915 | 0.71 | ITGB3 (0.43) | HTTITGB3ITGAV | |
| SCHEMBL6156731 | 0.70 | CASP1 (0.60) | — | |
| SCHEMBL6955527 | 0.70 | CASP1 (0.60) | — | |
| SCHEMBL6156740 | 0.70 | CASP1 (0.60) | — | |
| SCHEMBL7061672 | 0.69 | PPARG (0.51) | — | |
| SCHEMBL11616834 | 0.69 | HTT (1.00) | HTTNAMPTROCK2ROCK1POLB | |
| SCHEMBL3857870 | 0.68 | CASP1 (0.51) | — |
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-1147079-A2 | BETA-PHENYLALANINE DERIVATIVES AS INTEGRIN ANTAGONISTS | Bayer Aktiengesellschaft (DE) | 2001-10-24 | — | — | EP | disclosed |
| WO-2000041469-A2 | β-PHENYLALANINE DERIVATIVES AS INTEGRIN ANTAGONISTS | BAYER AKTIENGESELLSCHAFT (DE) | 2000-07-20 | — | — | WO | disclosed |