Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 5/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL925698 | 0.84 | CA2 (0.54) | CA2CAMK2AAKR1B1LMNAABCC4 | |
| SCHEMBL11210601 | 0.82 | ESR2 (0.47) | CYP2C9ESR2ESR1CYP3A4LMNA | |
| SCHEMBL11210597 | 0.82 | ESR2 (0.47) | CYP2C9ESR2ESR1CYP3A4LMNA | |
| Bicarbonate SCHEMBL11038434 | 0.82 | HAO1 (0.47) | CYP2C9ESR2ESR1CYP3A4HTT | |
| SCHEMBL5474554 | 0.82 | CYP2C9 (0.46) | CYP2C9ESR2ESR1CYP3A4LMNA | |
| SCHEMBL10817633 | 0.82 | NPC1 (0.55) | CYP2C9ESR2ESR1CYP3A4LMNA | |
| SCHEMBL9810457 | 0.82 | NPC1 (0.55) | CYP2C9ESR2ESR1CYP3A4LMNA | |
| SCHEMBL7731601 | 0.82 | CYP2C9 (0.46) | CYP2C9ESR2ESR1CYP3A4LMNA | |
| SCHEMBL9810459 | 0.82 | NPC1 (0.55) | CYP2C9ESR2ESR1CYP3A4LMNA | |
| SCHEMBL9342784 | 0.81 | ESR2 (0.46) | CYP2C9ESR2ESR1CYP3A4LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0391591-B1 | Pyrimidine derivative and liquid crystal composition incorporating the same | SEIKO EPSON CORP (JP) | 1994-06-15 | — | — | EP | disclosed |
| US-5200110-A | Electro-optical displays; heat resistance, dielectrics, low driving voltage, dielectrics | SEIKO EPSON CORPORATION (JP) | 1993-04-06 | — | — | US | disclosed |
| EP-0391591-A2 | Pyrimidine derivative and liquid crystal composition incorporating the same | SEIKO EPSON CORPORATION (JP) | 1990-10-10 | — | — | EP | disclosed |