Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 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 | |
|---|---|---|---|---|
| SCHEMBL9808837 | 0.96 | POLB (0.46) | POLBSERPINE1CA12CA1CA2 | |
| SCHEMBL8417643 | 0.84 | TSHR (0.58) | POLBSERPINE1TSHRMAPK1TP53 | |
| SCHEMBL9340876 | 0.83 | MAPT (0.49) | POLBSERPINE1CA12CA1CA2 | |
| SCHEMBL7129989 | 0.83 | MAPT (0.49) | POLBSERPINE1CA12CA1CA2 | |
| SCHEMBL7129984 | 0.83 | MAPT (0.49) | POLBSERPINE1CA12CA1CA2 | |
| SCHEMBL6936706 | 0.83 | SERPINE1 (0.53) | POLBSERPINE1CA12CA1CA2 | |
| SCHEMBL17912412 | 0.83 | TSHR (0.58) | POLBSERPINE1CA12CA1CA2 | |
| SCHEMBL9706347 | 0.80 | TSHR (0.43) | POLBTSHRMAPK1TP53CYP3A4 | |
| SCHEMBL7568997 | 0.78 | TSHR (0.66) | POLBCA2TSHRMAPK1TP53 | |
| SCHEMBL6868825 | 0.78 | TSHR (0.57) | TSHRMAPK1TP53CYP3A4LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5312564-A | Halogen-containing, optically active liquid crystal compound and liquid crystal composition containing same | CHISSO CORPORATION (JP) | 1994-05-17 | — | — | US | disclosed |
| US-4780242-A | BIPHENYL ESTERS | CHISSO CORPORATION (JP) | 1988-10-25 | — | — | US | disclosed |
| EP-0197677-A2 | Halogen-containing, optically active liquid crystal compound and liquid crystal composition containing same | Chisso Corporation (JP) | 1986-10-15 | — | — | EP | disclosed |