Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 5/20 | 0.44 |
| ▸ | NQO2 | P16083 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | PLK1 | P53350 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8734383 | 1.00 | PTGS2 (0.50) | PTGS2PTGS1ALOX5ESR1ESR2 | |
| SCHEMBL8732752 | 0.92 | ESR1 (0.57) | PTGS2PTGS1ESR1ESR2ALDH1A1 | |
| SCHEMBL8732745 | 0.92 | ESR1 (0.57) | PTGS2PTGS1ESR1ESR2ALDH1A1 | |
| SCHEMBL8732968 | 0.85 | ESR1 (0.50) | ESR1ESR2ALDH1A1THRBPLK1 | |
| SCHEMBL8729054 | 0.85 | ESR1 (0.50) | ESR1ESR2ALDH1A1THRBPLK1 | |
| SCHEMBL8729056 | 0.85 | ESR1 (0.50) | ESR1ESR2ALDH1A1THRBPLK1 | |
| SCHEMBL8732972 | 0.85 | ESR1 (0.50) | ESR1ESR2ALDH1A1THRBPLK1 | |
| SCHEMBL6546373 | 0.83 | ESR1 (0.47) | PTGS2PTGS1ESR1ESR2LMNA | |
| SCHEMBL6546477 | 0.83 | ESR1 (0.47) | PTGS2PTGS1ESR1ESR2LMNA | |
| SCHEMBL8734307 | 0.83 | PTGS1 (0.66) | PTGS2PTGS1ESR1ESR2NQO2 |
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-0834490-A1 | COMPOUNDS HAVING ALKYL-SUBSTITUTED ALKENYLENE MOIETY AND LIQUID CRYSTAL COMPOSITION | CHISSO CORPORATION (JP) | 1998-04-08 | — | — | EP | disclosed |