Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPB1 | P15086 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.35 |
| ▸ | JAK3 | P52333 | 3/20 | 0.35 |
| ▸ | LCK | P06239 | 2/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | BTK | Q06187 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.33 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | NAE1 | Q13564 | 1/20 | 0.33 |
| ▸ | UBA3 | Q8TBC4 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.33 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6867773 | 0.75 | ALDH1A1 (0.54) | TSHRMAPK8MAPK9MAPK10 | |
| SCHEMBL6930461 | 0.74 | ALDH1A1 (0.41) | GRIN2BJAK3LCKCDC7PIM1 | |
| SCHEMBL6459705 | 0.74 | GRIN2B (0.43) | GRIN2BMAPK8MAPK9MAPK10 | |
| SCHEMBL6876646 | 0.70 | MAPK8 (0.42) | TSHRMAPK8MAPK9MAPK10 | |
| SCHEMBL6874044 | 0.68 | AURKA (0.50) | EPHX2MAPK8MAPK9MAPK10 | |
| SCHEMBL6874037 | 0.68 | AURKA (0.50) | EPHX2MAPK8MAPK9MAPK10 | |
| SCHEMBL6879155 | 0.68 | DRD2 (0.42) | MAPK8MAPK9IDH1MAPK10PRMT5 | |
| SCHEMBL6879152 | 0.68 | DRD2 (0.42) | MAPK8MAPK9IDH1MAPK10PRMT5 | |
| SCHEMBL6877440 | 0.67 | MAPK8 (0.40) | EPHX2JAK3MAPK8MAPK9IDH1 | |
| SCHEMBL6877450 | 0.67 | MAPK8 (0.40) | EPHX2JAK3MAPK8MAPK9IDH1 |
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-2004087669-A1 | NOVEL QUINOLINE, TETRAHYDROQUINAZOLINE, AND PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF | TAISHO PHARMACEUTICAL CO. LTD. (JP) | 2004-10-14 | — | — | WO | disclosed |