Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | LIPC | P11150 | 1/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.39 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | IDH2 | P48735 | 3/20 | 0.37 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.37 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.37 |
| ▸ | ITGAL | P20701 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19346988 | 1.00 | CASP6 (0.41) | CASP6LIPCLIPGTLR8KMT2A | |
| SCHEMBL16238628 | 0.95 | CASP6 (0.40) | CASP6LIPCLIPGTLR8ITGB3 | |
| SCHEMBL17768260 | 0.94 | KMT2A (0.40) | CASP6LIPCLIPGKMT2ATSHR | |
| SCHEMBL19689730 | 0.92 | ITGB2 (0.42) | CASP6LIPGKMT2ATSHRITGB3 | |
| SCHEMBL19699710 | 0.92 | ITGB2 (0.42) | CASP6LIPGKMT2ATSHRITGB3 | |
| SCHEMBL19689756 | 0.91 | KMT2A (0.41) | CASP6KMT2ATSHRIDH2MEN1 | |
| Hydrochloric Acid SCHEMBL19689854 | 0.90 | KMT2A (0.40) | CASP6KMT2ATSHRIDH2MEN1 | |
| SCHEMBL17778734 | 0.90 | KCNH2 (0.42) | LIPGKMT2ATSHRIDH2ITGB2 | |
| SCHEMBL17618777 | 0.90 | ASAH1 (0.42) | KMT2ATSHRDRD2DRD3IDH2 | |
| SCHEMBL17618776 | 0.89 | ASAH1 (0.40) | KMT2ATSHRDRD2DRD3IDH2 |
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-9765075-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-09-19 | — | — | US | disclosed |