Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MDM2 | Q00987 | 13/20 | 0.41 |
| ▸ | TP53 | P04637 | 9/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6916644 | 0.99 | MDM2 (0.40) | MDM2TP53NPC1RAB9AKDM1A | |
| SCHEMBL13964536 | 0.90 | DRD2 (0.45) | MDM2TP53DRD2OPRM1DRD3 | |
| SCHEMBL13964539 | 0.89 | PSEN1 (0.40) | MDM2TP53 | |
| SCHEMBL10032827 | 0.89 | GPR88 (0.42) | TP53NPC1RAB9AKDM1AMAOA | |
| SCHEMBL2317676 | 0.88 | MDM2 (0.37) | MDM2TP53DRD2OPRM1DRD3 | |
| SCHEMBL2317856 | 0.88 | DRD2 (0.39) | MDM2TP53KDM1AMAOAMAOB | |
| SCHEMBL6917782 | 0.87 | SIGMAR1 (0.45) | RAB9A | |
| SCHEMBL2315528 | 0.85 | PSEN1 (0.40) | MAOA | |
| SCHEMBL1709485 | 0.85 | PSEN1 (0.40) | MAOA | |
| SCHEMBL2313658 | 0.85 | PSEN1 (0.41) | MDM2TP53KDM1AMAOAMAOB |
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-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |