Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 6/20 | 0.36 |
| ▸ | MKNK2 | Q9HBH9 | 6/20 | 0.36 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.36 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | F7 | P08709 | 1/20 | 0.34 |
| ▸ | F3 | P13726 | 1/20 | 0.34 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.34 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.34 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.34 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.34 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.34 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.34 |
| ▸ | NNMT | P40261 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9996419 | 0.71 | NAPRT (0.44) | MKNK1MKNK2P2RX7TSHRALDH1A1 | |
| SCHEMBL14968784 | 0.70 | P2RX7 (0.43) | MKNK1P2RX7TSHRF7F3 | |
| SCHEMBL1445286 | 0.69 | MAP4K4 (0.54) | CYP17A1MKNK1MKNK2CHEK2MAP4K4 | |
| SCHEMBL30251063 | 0.68 | CHEK2 (0.57) | CYP17A1MKNK1MKNK2CHEK2TSHR | |
| SCHEMBL2176759 | 0.68 | P2RX7 (0.42) | MKNK1P2RX7TSHRSIRT3 | |
| SCHEMBL23882643 | 0.68 | CHEK2 (0.57) | CYP17A1MKNK1MKNK2CHEK2TSHR | |
| SCHEMBL2176754 | 0.68 | P2RX7 (0.42) | MKNK1P2RX7TSHRSIRT3 | |
| SCHEMBL23559581 | 0.67 | CYP17A1 (0.49) | CYP17A1MKNK1MKNK2CHEK2TSHR | |
| SCHEMBL13434906 | 0.66 | ROCK1 (0.61) | MKNK1ROCK1 | |
| SCHEMBL4557709 | 0.66 | ALDH1A1 (0.44) | P2RX7SMN1; SMN2ALDH1A1KMT2A |
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-1868611-A4 | NOVEL COMPOUNDS | GLAXO GROUP LTD (GB) | 2009-05-27 | — | — | EP | disclosed |
| EP-1868611-A2 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2007-12-26 | — | — | EP | disclosed |
| WO-2006104915-A2 | 8-PHENYL-7,8-DIHYDROPYRIDO[2,3-d]PYRIMIDIN-7-ONES AND THEIR USE AS PHARMACEUTICALS | GLAXO GROUP LIMITED (GB) | 2006-10-05 | — | — | WO | disclosed |