Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 6/20 | 0.46 |
| ▸ | ITGAV | P06756 | 6/20 | 0.46 |
| ▸ | ITGB1 | P05556 | 3/20 | 0.46 |
| ▸ | ITGA5 | P08648 | 3/20 | 0.46 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.43 |
| ▸ | MC4R | P32245 | 12/20 | 0.43 |
| ▸ | MC5R | P33032 | 12/20 | 0.43 |
| ▸ | MC3R | P41968 | 12/20 | 0.43 |
| ▸ | MC1R | Q01726 | 12/20 | 0.43 |
| ▸ | ITGB5 | P18084 | 4/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14262667 | 0.95 | ITGB3 (0.46) | ITGB3ITGAVITGB1ITGA5CXCR4 | |
| SCHEMBL14075719 | 0.94 | ITGB3 (0.54) | ITGB3ITGAVITGB1ITGA5MC4R | |
| SCHEMBL14262562 | 0.91 | KEAP1 (0.43) | ITGB3ITGAVITGB1ITGA5CXCR4 | |
| SCHEMBL14262361 | 0.91 | ITGB3 (0.45) | ITGB3ITGAVITGB1ITGA5CXCR4 | |
| SCHEMBL14262356 | 0.90 | MC4R (0.43) | ITGB3ITGAVITGB1ITGA5CXCR4 | |
| SCHEMBL14075705 | 0.89 | ITGB3 (0.53) | ITGB3ITGAVITGB1ITGA5MC4R | |
| SCHEMBL14262362 | 0.89 | ITGB3 (0.43) | ITGB3ITGAVITGB1ITGA5CXCR4 | |
| SCHEMBL14075661 | 0.87 | ITGB3 (0.50) | ITGB3ITGAVITGB1ITGA5MC4R | |
| SCHEMBL14075722 | 0.85 | ITGB3 (0.50) | ITGB3ITGAVITGB1ITGA5MC4R | |
| SCHEMBL14075695 | 0.85 | ITGB3 (0.53) | ITGB3ITGAVITGB1ITGA5CXCR4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008033557-A2 | CLICK CHEMISTRY-DERIVED CYCLIC PEPTIDOMIMETICS AS INTEGRIN MARKERS | SIEMENS MEDICAL SOLUTIONS USA, INC. (US) | 2008-03-20 | — | — | WO | disclosed |