Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.54 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | F7 | P08709 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | F3 | P13726 | 1/20 | 0.47 |
| ▸ | AHR | P35869 | 1/20 | 0.47 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | CDK9 | P50750 | 2/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.45 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.45 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.45 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.45 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15757343 | 0.78 | BPTF (0.64) | NPC1ADORA2AADORA1CA12CA1 | |
| SCHEMBL14413322 | 0.76 | CYP1A2 (0.74) | HSP90AA1HSP90AB1KDM4ENPC1ADORA2A | |
| SCHEMBL1271841 | 0.76 | BPTF (0.49) | NPC1F7LTA4HF3AHR | |
| SCHEMBL3951575 | 0.74 | HSP90AB1 (0.72) | HSP90AA1HSP90AB1KDM4ENPC1ADORA2A | |
| SCHEMBL14413753 | 0.74 | HSP90AA1 (0.72) | HSP90AA1HSP90AB1KDM4EADORA2AADORA1 | |
| SCHEMBL864044 | 0.74 | CHRNA7 (0.50) | NPC1F7LTA4HF3AHR | |
| SCHEMBL2777755 | 0.74 | MEN1 (0.60) | NPC1F7LTA4HF3AHR | |
| SCHEMBL15757975 | 0.74 | AURKA (0.58) | NPC1ADORA2AADORA1FYNNISCH | |
| SCHEMBL5850255 | 0.73 | NPC1 (0.79) | NPC1F7LTA4HF3AHR | |
| SCHEMBL6637115 | 0.72 | GUSB (0.51) | NPC1ADORA2AADORA1DYRK1ADYRK1B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1515965-B1 | PHENYLAMINOPYRIMIDINES AND THEIR USE AS RHO-KINASE INHIBITORS | BAYER SCHERING PHARMA AG (DE) | 2010-10-06 | — | — | EP | disclosed |
| EP-1515965-B1 | PHENYLAMINOPYRIMIDINES AND THEIR USE AS RHO-KINASE INHIBITORS | BAYER SCHERING PHARMA AG (DE) | 2010-10-06 | — | — | EP | disclosed |
| EP-1515965-A1 | PHENYLAMINOPYRIMIDINES AND THEIR USE AS RHO-KINASE INHIBITORS | Bayer Aktiengesellschaft (DE) | 2005-03-23 | — | — | EP | disclosed |
| WO-2003106450-A1 | PHENYLAMINOPYRIMIDINES AND THEIR USE AS RHO-KINASE INHIBITORS | BAYER AKTIENGESELLSCHAFT (DE) | 2003-12-24 | — | — | WO | disclosed |