Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.33 |
| ▸ | AKT1 | P31749 | 2/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 4/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.32 |
| ▸ | CDK1 | P06493 | 2/20 | 0.32 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.32 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13772294 | 1.00 | RPS6KB1 (0.33) | RPS6KB1AKT1AURKBINCENPAURKA | |
| SCHEMBL3000212 | 1.00 | RPS6KB1 (0.33) | RPS6KB1AKT1AURKBINCENPAURKA | |
| SCHEMBL6223797 | 0.94 | CYP1A2 (0.38) | RPS6KB1AKT1AURKBINCENPAURKA | |
| SCHEMBL4141467 | 0.91 | ALDH1A1 (0.37) | ALDH1A1LMNAHRH4ROCK2CDK1 | |
| SCHEMBL3003700 | 0.91 | EGFR (0.35) | RPS6KB1AURKAALDH1A1LMNAHRH4 | |
| SCHEMBL8323127 | 0.91 | ALDH1A1 (0.37) | ALDH1A1LMNAHRH4ROCK2CDK1 | |
| SCHEMBL4162062 | 0.91 | AURKA (0.33) | RPS6KB1AKT1AURKBINCENPAURKA | |
| SCHEMBL4141464 | 0.91 | ALDH1A1 (0.37) | ALDH1A1LMNAHRH4ROCK2CDK1 | |
| SCHEMBL8317288 | 0.91 | CNR1 (0.36) | RPS6KB1AKT1AURKBINCENPAURKA | |
| SCHEMBL2986556 | 0.91 | ITGAV (0.35) | RPS6KB1AURKAALDH1A1LMNACNR1 |
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-2004058743-A1 | NOVEL SUBSTITUTED NITROGEN-CONTAINING HETEROBICYCLES AND USE THEREOF AS FACTOR XA INHIBITORS | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2004-07-15 | — | — | WO | disclosed |