Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | NR2E3 | Q9Y5X4 | 3/20 | 0.46 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.46 |
| ▸ | PPARG | P37231 | 2/20 | 0.46 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 7/20 | 0.43 |
| ▸ | RIN1 | Q13671 | 7/20 | 0.43 |
| ▸ | APEX1 | P27695 | 3/20 | 0.42 |
| ▸ | NSD2 | O96028 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | IDE | P14735 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13049629 | 1.00 | TDP1 (0.46) | TDP1ALDH1A1NR2E3MAPK10PPARG | |
| SCHEMBL13079659 | 0.88 | TDP1 (0.48) | TDP1ALDH1A1NR2E3MAPK10PPARG | |
| SCHEMBL13049573 | 0.83 | TDP1 (0.53) | TDP1CNR1CNR2 | |
| SCHEMBL16938350 | 0.83 | TDP1 (0.53) | TDP1CNR1CNR2 | |
| SCHEMBL21957563 | 0.80 | TDP1 (0.66) | TDP1ALDH1A1NR2E3MAPK10PPARG | |
| SCHEMBL20635796 | 0.80 | TDP1 (0.66) | TDP1ALDH1A1NR2E3MAPK10PPARG | |
| SCHEMBL13049571 | 0.77 | APEX1 (0.47) | ALDH1A1APEX1EPHX2 | |
| SCHEMBL3731666 | 0.76 | APEX1 (0.61) | TDP1ALDH1A1HPGDAPEX1CNR1 | |
| SCHEMBL3731663 | 0.76 | APEX1 (0.61) | TDP1ALDH1A1HPGDAPEX1CNR1 | |
| SCHEMBL3750888 | 0.76 | APEX1 (0.61) | TDP1ALDH1A1HPGDAPEX1CNR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9089605-B2 | Quinone derivatives, pharmaceutical compositions, and uses thereof | INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) | 2015-07-28 | — | — | US | disclosed |