Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | ECE1 | P42892 | 1/20 | 0.47 |
| ▸ | MUS81 | Q96NY9 | 1/20 | 0.47 |
| ▸ | CDC25B | P30305 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | CASP1 | P29466 | 3/20 | 0.45 |
| ▸ | BLM | P54132 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | CASP7 | P55210 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | AOC1 | P19801 | 2/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.36 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.36 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
| ▸ | CCND1 | P24385 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8788434 | 0.84 | MAOA (0.47) | MAOAMAOBECE1MUS81CDC25B | |
| SCHEMBL8789326 | 0.82 | MAOA (0.45) | MAOAMAOBECE1MUS81CDC25B | |
| SCHEMBL8792588 | 0.81 | ECE1 (0.45) | MAOAMAOBECE1MUS81CDC25B | |
| SCHEMBL4198601 | 0.80 | MAPT (0.46) | MAOAMAOBCDC25BMAPTCYP3A4 | |
| SCHEMBL4193002 | 0.79 | THRB (0.33) | MAPTBLMSMN1; SMN2MAPK1CCNE2 | |
| Pixantrone SCHEMBL7825 | 0.74 | ECE1 (0.72) | MAOAMAOBECE1MUS81CDC25B | |
| Pixantrone SCHEMBL29372192 | 0.74 | ECE1 (0.72) | MAOAMAOBECE1MUS81CDC25B | |
| SCHEMBL8789103 | 0.74 | ECE1 (0.55) | MAOAMAOBECE1MUS81CDC25B | |
| SCHEMBL8788509 | 0.74 | ECE1 (0.52) | MAOAMAOBECE1MUS81CDC25B | |
| Pixantrone SCHEMBL17673194 | 0.73 | ECE1 (0.70) | MAOAMAOBECE1MUS81CDC25B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0503537-B1 | 6,9 Bis(substituted-amino)benzo-[g]isoquinoline-5,10-diones | UNIV VERMONT (US) | 1997-05-14 | — | — | EP | disclosed |
| EP-0503537-A1 | 6,9 Bis(substituted-amino)benzo-[g]isoquinoline-5,10-diones | THE UNIVERSITY OF VERMONT (US) | 1992-09-16 | — | — | EP | disclosed |