Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 1/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.39 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | MDM2 | Q00987 | 11/20 | 0.37 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12366233 | 0.96 | CNR1 (0.42) | ITGB1ITGA4ITGB7CNR1TP53 | |
| SCHEMBL12366250 | 0.94 | MAPT (0.40) | ITGB1ITGA4ITGB7CNR1TP53 | |
| SCHEMBL12366493 | 0.92 | MDM2 (0.36) | ITGB1ITGA4ITGB7CNR1MAPT | |
| SCHEMBL12366330 | 0.92 | RGS4 (0.41) | TP53HPGDALDH1A1MAPTMDM2 | |
| SCHEMBL12366288 | 0.92 | MDM2 (0.41) | MDM2 | |
| SCHEMBL12366342 | 0.92 | TP53 (0.41) | ITGB1ITGA4ITGB7TP53HPGD | |
| SCHEMBL12366345 | 0.91 | NR1H2 (0.43) | ITGB1ITGA4ITGB7CNR1TP53 | |
| SCHEMBL12366746 | 0.91 | PTGS2 (0.36) | ITGB1ITGA4ITGB7MAPTMDM2 | |
| SCHEMBL12366335 | 0.91 | LMNA (0.35) | ITGB1ITGA4ITGB7CNR1TP53 | |
| SCHEMBL12366256 | 0.91 | POLB (0.38) | CNR1TP53ALDH1A1MAPTMDM2 |
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-7998986-B2 | Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors | EXELIXIS PATENT COMPANY LLC (US) | 2011-08-16 | — | — | US | disclosed |