Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.85 |
| ▸ | ITGAV | P06756 | 1/20 | 0.85 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | PTP4A3 | O75365 | 1/20 | 0.53 |
| ▸ | DUSP26 | Q9BV47 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12717644 | 0.92 | ITGB3 (1.00) | ITGB3ITGAVALDH1A1POLBMAPT | |
| SCHEMBL12717765 | 0.77 | PTP4A3 (0.83) | ITGB3ITGAVALDH1A1POLBMAPT | |
| SCHEMBL20846416 | 0.71 | PTP4A3 (0.70) | ITGB3ITGAVALDH1A1POLBMAPT | |
| SCHEMBL12717766 | 0.68 | PTPN1 (0.60) | ITGB3ITGAVALDH1A1POLBMAPT | |
| SCHEMBL12177463 | 0.66 | TDP1 (0.58) | ITGB3ITGAVALDH1A1POLBMAPT | |
| SCHEMBL23094519 | 0.66 | CGAS (0.78) | ITGB3ITGAVALDH1A1MAPTMEN1 | |
| SCHEMBL12177573 | 0.66 | AURKA (0.60) | TDP1LMNADUSP26AURKA | |
| SCHEMBL12177391 | 0.64 | PTPN2 (0.57) | ITGB3ITGAVALDH1A1POLBMAPT | |
| SCHEMBL12177693 | 0.64 | TDP1 (0.50) | ITGB3ITGAVALDH1A1POLBMAPT | |
| SCHEMBL12177369 | 0.64 | LMNA (0.62) | ALDH1A1POLBMAPTTDP1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7928113-B2 | Integrin-binding small molecules | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2011-04-19 | — | — | US | disclosed |