Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | BCL6 | P41182 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11408825 | 0.84 | BCL6 (0.37) | HSP90AA1BCL6SMN1; SMN2ADORA3SLC6A2 | |
| SCHEMBL27460220 | 0.82 | ALDH1A1 (0.45) | BCL6RAB9AHTTKDM4EGAA | |
| SCHEMBL27401919 | 0.77 | ROCK1 (0.42) | RAB9AKDM4EGAA | |
| SCHEMBL65511 | 0.73 | — | — | |
| SCHEMBL9562215 | 0.70 | HSP90AA1 (0.50) | HSP90AA1BCL6SMN1; SMN2ADORA3SLC6A2 | |
| Hydrochloric Acid SCHEMBL15477068 | 0.70 | — | — | |
| Water SCHEMBL6396886 | 0.70 | HSP90AA1 (0.50) | HSP90AA1BCL6SMN1; SMN2ADORA3SLC6A2 | |
| Boric Acid SCHEMBL8843768 | 0.69 | HSP90AA1 (0.43) | HSP90AA1BCL6SMN1; SMN2ADORA3SLC6A2 | |
| SCHEMBL7116475 | 0.69 | BCL6 (0.44) | HSP90AA1BCL6SMN1; SMN2ADORA3HTT | |
| Benzene SCHEMBL29138620 | 0.68 | BCL6 (0.52) | HSP90AA1BCL6SMN1; SMN2ADORA3SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1439175-B1 | PYRIMIDINE COMPOUND AND MEDICINAL COMPOSITION THEREOF | EISAI R&D MAN CO LTD (JP) | 2011-04-27 | — | — | EP | disclosed |