Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.41 |
| ▸ | ITGAV | P06756 | 2/20 | 0.41 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 4/20 | 0.39 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7863259 | 0.86 | PKM (0.46) | PKMITGB3ITGAVF2F10 | |
| SCHEMBL7856452 | 0.83 | PKM (0.43) | PKMITGB3ITGAVF2F10 | |
| SCHEMBL7856455 | 0.83 | PKM (0.43) | PKMITGB3ITGAVF2F10 | |
| SCHEMBL8371142 | 0.83 | PFKFB3 (0.43) | PKMPFKFB3CA1CA2HTR6 | |
| SCHEMBL7864234 | 0.82 | PGR (0.41) | ITGB3ITGAVPFKFB3HTR6POLB | |
| SCHEMBL7866912 | 0.82 | SMN1; SMN2 (0.41) | ITGB3ITGAVPFKFB3HDAC2HDAC8 | |
| SCHEMBL7861775 | 0.82 | EEF2K (0.43) | ITGB3ITGAVPFKFB3CA1CA2 | |
| SCHEMBL7864756 | 0.81 | CA1 (0.38) | PKMITGB3ITGAVPFKFB3CA1 | |
| SCHEMBL7864664 | 0.81 | GBA1 (0.39) | PKMITGB3ITGAVPFKFB3CA1 | |
| SCHEMBL7864164 | 0.80 | HDAC4 (0.38) | PKMITGB3ITGAVPFKFB3CA1 |
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-0889877-B1 | META-SUBSTITUTED PHENYLENE DERIVATIVES AND THEIR USE AS ALPHAvBETA3 INTEGRIN ANTAGONISTS OR INHIBITORS | SEARLE & CO (US) | 2001-08-29 | — | — | EP | claimed |
| EP-0889877-B1 | META-SUBSTITUTED PHENYLENE DERIVATIVES AND THEIR USE AS ALPHAvBETA3 INTEGRIN ANTAGONISTS OR INHIBITORS | SEARLE & CO (US) | 2001-08-29 | — | — | EP | disclosed |