Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | TOP1 | P11387 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL13908975 | 0.78 | NFE2L2 (0.54) | CYP3A4TDP1KDM4EALDH1A1 | |
| SCHEMBL8100149 | 0.77 | CYP3A4 (0.35) | CYP3A4TDP1DRD1 | |
| SCHEMBL13908991 | 0.75 | ALOX5 (0.45) | CYP3A4TDP1DRD1KDM4EGAA | |
| SCHEMBL8143668 | 0.75 | CYP3A4 (0.46) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL705407 | 0.75 | TDP1 (0.50) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL29809925 | 0.75 | CYP3A4 (0.46) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL503707 | 0.75 | CYP3A4 (0.46) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL10309892 | 0.74 | CYP3A4 (0.41) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL8104276 | 0.74 | CYP3A4 (0.37) | CYP3A4TDP1DRD1ESR1ESR2 | |
| SCHEMBL333122 | 0.72 | NFE2L2 (0.41) | CYP3A4TDP1KDM4EMEN1KMT2A |
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-20090056811-A1 | POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE USING THE SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2009-03-05 | — | — | US | disclosed |