Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 9/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.44 |
| ▸ | CDK2 | P24941 | 4/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3262477 | 0.95 | AURKA (0.45) | AURKAPTGS2RAB9AKDM4EDRD2 | |
| SCHEMBL3390010 | 0.90 | RAB9A (0.49) | AURKAPTGS2RAB9AKDM4EMAPT | |
| SCHEMBL17156406 | 0.83 | NPC1 (0.40) | AURKARAB9AKDM4EDRD2MAPT | |
| SCHEMBL11825032 | 0.83 | KDM4E (0.54) | AURKAPTGS2RAB9AKDM4EDRD2 | |
| SCHEMBL11824863 | 0.78 | FABP3 (0.51) | AURKAPTGS2KDM4EDRD2 | |
| SCHEMBL11829096 | 0.77 | MAP4K4 (0.47) | AURKARAB9AKDM4EDRD2MAPT | |
| SCHEMBL11762255 | 0.76 | NPC1 (0.65) | AURKARAB9AKDM4EDRD2MAPT | |
| SCHEMBL11763853 | 0.74 | RAB9A (0.70) | AURKAPTGS2RAB9AKDM4EDRD2 | |
| SCHEMBL3263525 | 0.74 | RAB9A (0.43) | AURKARAB9AMAPT | |
| SCHEMBL11827086 | 0.74 | PTGS2 (0.53) | AURKAPTGS2RAB9AKDM4EDRD2 |
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-2010015656-A2 | NEW ALKOXYPYRAZOLES | INSTITUT PASTEUR (FR) | 2010-02-11 | — | — | WO | disclosed |