Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.55 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.38 |
| ▸ | TYR | P14679 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL7066672 | 0.92 | ESR1 (0.57) | ESR1ESR2ACE2ALOX5 | |
| SCHEMBL7914528 | 0.87 | ESR1 (0.60) | ESR1ESR2CYP3A4TSHR | |
| SCHEMBL7914460 | 0.81 | ESR1 (0.56) | ESR1ESR2 | |
| SCHEMBL14237472 | 0.81 | ESR1 (0.46) | ESR1ESR2ACE2KMT2A | |
| SCHEMBL21538491 | 0.80 | ESR1 (0.69) | ESR1ESR2MEN1CYP3A4TSHR | |
| SCHEMBL3827047 | 0.79 | ESR1 (0.50) | ESR1ESR2 | |
| SCHEMBL7913505 | 0.78 | ESR1 (0.54) | ESR1ESR2ACE2 | |
| SCHEMBL29404012 | 0.77 | ESR1 (0.65) | ESR1ESR2MEN1TP53CYP3A4 | |
| SCHEMBL29459501 | 0.77 | ESR1 (0.65) | ESR1ESR2MEN1TP53CYP3A4 | |
| SCHEMBL244496 | 0.77 | ESR1 (0.65) | ESR1ESR2MEN1TP53CYP3A4 |
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-0995737-B1 | Process for producing 3,3,5-trimethylcyclohexylidenebisphenols | HONSHU CHEMICAL IND (JP) | 2003-06-04 | — | — | EP | disclosed |
| 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 |
| EP-0995737-A1 | Process for producing 3,3,5-trimethylcyclohexylidenebisphenols | Honshu Chemical Industry Co. Ltd. (JP) | 2000-04-26 | — | — | EP | disclosed |