Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.34 |
| ▸ | XPO1 | O14980 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.31 |
| ▸ | COMT | P21964 | 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 | |
|---|---|---|---|---|
| SCHEMBL21556263 | 1.00 | ABCB1 (0.34) | ABCB1XPO1HDAC1GSTO1COMT | |
| SCHEMBL21556185 | 0.76 | XPO1 (0.44) | XPO1 | |
| SCHEMBL1592489 | 0.71 | XPO1 (0.45) | XPO1 | |
| SCHEMBL24465022 | 0.68 | XPO1 (0.42) | XPO1 | |
| SCHEMBL1592486 | 0.67 | XPO1 (0.48) | XPO1 | |
| SCHEMBL24465012 | 0.67 | XPO1 (0.40) | XPO1 | |
| SCHEMBL21556239 | 0.64 | XPO1 (0.41) | XPO1 | |
| SCHEMBL1592871 | 0.60 | BACE1 (0.47) | XPO1 | |
| SCHEMBL8131521 | 0.58 | MAPT (0.54) | XPO1 | |
| SCHEMBL8141682 | 0.57 | CYP1A2 (0.67) | XPO1 |
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-3088397-B1 | COMPOUNDS THAT ABROGATE THE CELL CYCLE G2 CHECKPOINT FOR USE IN THE TREATMENT OF CANCER | CANBAS CO LTD (JP) | 2019-04-10 | — | — | EP | disclosed |