Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | PLCD1 | P51178 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.37 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.37 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.37 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.37 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.37 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.37 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.37 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3758247 | 1.00 | TDP1 (0.42) | TDP1CYP3A4PLCD1DRD2TPSAB1 | |
| SCHEMBL13049595 | 1.00 | TDP1 (0.42) | TDP1CYP3A4PLCD1DRD2TPSAB1 | |
| SCHEMBL4962526 | 0.86 | TDP1 (0.50) | TDP1PLCD1TPSAB1F2PRSS1 | |
| SCHEMBL19751702 | 0.85 | TDP1 (0.48) | TDP1PLCD1TPSAB1F2PRSS1 | |
| SCHEMBL4965653 | 0.85 | TDP1 (0.48) | TDP1PLCD1TPSAB1F2PRSS1 | |
| SCHEMBL18501099 | 0.85 | TDP1 (0.48) | TDP1PLCD1TPSAB1F2PRSS1 | |
| SCHEMBL3758250 | 0.84 | TDP1 (0.48) | TDP1PLCD1TPSAB1F2PRSS1 | |
| SCHEMBL13080217 | 0.84 | TDP1 (0.48) | TDP1PLCD1TPSAB1F2PRSS1 | |
| SCHEMBL13049592 | 0.84 | TDP1 (0.48) | TDP1PLCD1TPSAB1F2PRSS1 | |
| SCHEMBL13049465 | 0.84 | TDP1 (0.48) | TDP1PLCD1TPSAB1F2PRSS1 |
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-2203161-B1 | QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF | UNIV INDIANA RES & TECH CORP (US) | 2018-05-09 | — | — | EP | disclosed |