Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.60 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.60 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL3827047 | 0.91 | ESR1 (0.50) | ESR1ESR2 | |
| SCHEMBL7066672 | 0.89 | ESR1 (0.57) | ESR1ESR2CNR2 | |
| SCHEMBL7066675 | 0.87 | ESR1 (0.55) | ESR1ESR2CYP3A4TSHR | |
| SCHEMBL7914460 | 0.85 | ESR1 (0.56) | ESR1ESR2 | |
| SCHEMBL7916059 | 0.84 | ESR1 (0.56) | ESR1ESR2CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL21538491 | 0.84 | ESR1 (0.69) | ESR1ESR2CNR2CYP3A4ALDH1A1 | |
| SCHEMBL2779569 | 0.82 | ESR1 (0.42) | ESR1ESR2BACE1HSD17B1HSP90AA1 | |
| SCHEMBL29404012 | 0.81 | ESR1 (0.65) | ESR1ESR2CYP3A4ALDH1A1LMNA | |
| SCHEMBL29459501 | 0.81 | ESR1 (0.65) | ESR1ESR2CYP3A4ALDH1A1LMNA | |
| SCHEMBL244496 | 0.81 | ESR1 (0.65) | ESR1ESR2CYP3A4ALDH1A1LMNA |
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-6284931-B1 | REACTION OF 3,3,5-TRIMETHYLCYCLOHEXANONE AND PHENOL TO FORM DIPHENOL DERIVATIVE | HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) | 2001-09-04 | — | — | US | disclosed |
| US-6217995-B1 | TRANSPARENT POLYCARBONATE OR POLYESTERCARABONATE CONTAINING CYCLIC ALIPHATIC GROUP, HAVING A VISIBLE LIGHT TRANSMITTANCE MORE THAN 80% AND A GLASS TRANSITION TEMPERATURE LESS THAN 80 DEGREE C. EXHIBIT BIREFRINGENCE INDEX LESS THAN 15 NM | MITSUBISHI CHEMICAL CORPORATION (JP) | 2001-04-17 | — | — | US | disclosed |
| EP-0995737-A1 | Process for producing 3,3,5-trimethylcyclohexylidenebisphenols | Honshu Chemical Industry Co. Ltd. (JP) | 2000-04-26 | — | — | EP | disclosed |