Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 10/20 | 0.54 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.54 |
| ▸ | PIM1 | P11309 | 2/20 | 0.54 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.44 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.44 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.44 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.42 |
| ▸ | WDR77 | Q9BQA1 | 2/20 | 0.42 |
| ▸ | KDM4A | O75164 | 1/20 | 0.41 |
| ▸ | KDM4B | O94953 | 1/20 | 0.41 |
| ▸ | KDM5C | P41229 | 1/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL393560 | 1.00 | PARP1 (0.54) | PARP1CHEK1PIM1RPS6KA3ALDH1A1 | |
| SCHEMBL8212169 | 0.89 | PARP1 (0.54) | PARP1CHEK1PIM1RPS6KA3PDPK1 | |
| SCHEMBL2379179 | 0.80 | LPL (0.40) | ALDH1A1CA9LPLLIPG | |
| SCHEMBL3263058 | 0.78 | PRMT5 (0.40) | CA12CA9PRMT5WDR77LPL | |
| SCHEMBL31037319 | 0.77 | KDM4E (0.48) | PARP1ALDH1A1SMN1; SMN2TNKS2PRMT5 | |
| SCHEMBL3263196 | 0.77 | KDM4E (0.48) | PARP1ALDH1A1SMN1; SMN2TNKS2PRMT5 | |
| SCHEMBL29525463 | 0.77 | MMP12 (0.45) | LPLLIPG | |
| SCHEMBL874992 | 0.77 | MMP12 (0.45) | LPLLIPG | |
| SCHEMBL391998 | 0.75 | GSK3A (0.46) | PARP1CHEK1PIM1RPS6KA3ALDH1A1 | |
| SCHEMBL3225882 | 0.75 | PRMT5 (0.40) | CA12CA9PRMT5WDR77LPL |
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-4313967-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2024-02-07 | — | — | EP | disclosed |
| WO-2022212194-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2022-10-06 | — | — | WO | disclosed |