Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8038463 | 1.00 | EPHX2 (0.39) | EPHX2TBXA2RTRPV1EGFRMGLL | |
| SCHEMBL8034312 | 0.99 | TBXA2R (0.38) | EPHX2TBXA2RTRPV1EGFRMGLL | |
| SCHEMBL8037015 | 0.89 | ALDH1A1 (0.45) | EGFR | |
| SCHEMBL8035781 | 0.88 | EPHX2 (0.41) | EPHX2TRPV1MGLL | |
| SCHEMBL8041445 | 0.88 | EPHX2 (0.41) | EPHX2TRPV1MGLL | |
| SCHEMBL8023142 | 0.87 | ALDH1A1 (0.39) | — | |
| SCHEMBL8035726 | 0.82 | CYP3A4 (0.35) | TRPV1 | |
| SCHEMBL8038459 | 0.81 | TRPV1 (0.39) | TBXA2RTRPV1EGFRMGLL | |
| SCHEMBL8035149 | 0.80 | NPSR1 (0.36) | — | |
| SCHEMBL8035145 | 0.79 | LRRK2 (0.35) | — |
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-2009081892-A1 | NOVEL CATECHOL DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND USE OF THOSE | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 2009-07-02 | — | — | WO | disclosed |