Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.45 |
| ▸ | ITGAV | P06756 | 1/20 | 0.45 |
| ▸ | NTSR1 | P30989 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| Leucine SCHEMBL1414045 | 0.97 | ITGB3 (0.47) | ITGB3ITGAVNTSR1CYP3A4CYP2C9 | |
| SCHEMBL232948 | 0.92 | ITGB3 (0.45) | ITGB3ITGAVNTSR1CYP3A4CYP2C9 | |
| Alanine SCHEMBL601223 | 0.90 | ITGB3 (0.44) | ITGB3ITGAVNTSR1CYP3A4CYP2C9 | |
| SCHEMBL3194343 | 0.86 | ITGB3 (0.43) | ITGB3ITGAVNTSR1CYP3A4CYP2C9 | |
| SCHEMBL31238101 | 0.83 | PSMB5 (0.54) | ITGB3ITGAVNTSR1CYP3A4CYP2C9 | |
| SCHEMBL7217344 | 0.82 | MAPT (0.53) | ITGB3ITGAVNTSR1CYP3A4CYP2C9 | |
| SCHEMBL5098994 | 0.80 | NTSR1 (0.58) | ITGB3ITGAVNTSR1CYP3A4CYP2C9 | |
| SCHEMBL5099014 | 0.80 | NTSR1 (0.58) | ITGB3ITGAVNTSR1CYP3A4CYP2C9 | |
| SCHEMBL7161574 | 0.78 | NPSR1 (0.48) | ITGB3ITGAVNTSR1CYP3A4CYP2C9 | |
| SCHEMBL1406185 | 0.78 | GAA (0.38) | ITGB3ITGAVNTSR1CYP3A4CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0788360-B3 | BORONIC ESTER AND ACID COMPOUNDS, SYNTHESIS AND USES | MILLENNIUM PHARM INC (US) | 2009-08-12 | — | — | EP | claimed |
| EP-1312609-B1 | Boronic ester and acid compounds, synthesis and uses | MILLENNIUM PHARM INC (US) | 2005-12-28 | — | — | EP | claimed |
| EP-0788360-B1 | BORONIC ESTER AND ACID COMPOUNDS, SYNTHESIS AND USES | MILLENNIUM PHARM INC (US) | 2003-05-28 | — | — | EP | claimed |