Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 2/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.34 |
| ▸ | MAP2 | P11137 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | MAP3K8 | P41279 | 1/20 | 0.34 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.33 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | ASIC3 | Q9UHC3 | 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 | |
|---|---|---|---|---|
| SCHEMBL20553500 | 0.76 | MAPT (0.41) | DHODHROCK2KDM4CKMT2A | |
| SCHEMBL2004642 | 0.74 | IKBKB (0.36) | DHODHCDC7CCNE1CDK2DBF4 | |
| SCHEMBL3790263 | 0.73 | KCNN4 (0.41) | KIF11ROCK2MAPK10NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL3787410 | 0.72 | KCNN4 (0.39) | KIF11ROCK2MAPK10NPC1RAB9A | |
| SCHEMBL13723572 | 0.68 | MKNK1 (0.43) | PARP1CDC7CCNE1CDK2DBF4 | |
| SCHEMBL13724829 | 0.68 | MKNK1 (0.43) | PARP1DHODHALDH1A1SMN1; SMN2PTPN5 | |
| SCHEMBL21714414 | 0.66 | IKBKB (0.39) | ROCK2KDM4CKMT2A | |
| SCHEMBL10305531 | 0.66 | KCNN4 (0.56) | PARP1SMN1; SMN2PTPN1PTPN5 | |
| SCHEMBL24394795 | 0.65 | PDE10A (0.40) | ALDH1A1MAPK10 | |
| SCHEMBL12215972 | 0.65 | RAB9A (0.61) | ALDH1A1SMN1; SMN2KMT2AMAPK10NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011075383-A1 | INHIBITORS OF AKT ACTIVITY | MERCK SHARP & DOHME CORP. (US) | 2011-06-23 | — | — | WO | disclosed |