Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.73 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | AR | P10275 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.53 |
| ▸ | HTR6 | P50406 | 1/20 | 0.53 |
| ▸ | ESRRG | P62508 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | CNR1 | P21554 | 4/20 | 0.47 |
| ▸ | CNR2 | P34972 | 4/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TYR | P14679 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21082793 | 0.91 | ESR1 (0.74) | ESR1ESR2ALDH1A1CYP3A4TSHR | |
| SCHEMBL28106853 | 0.91 | ESR1 (0.67) | ESR1ESR2ALDH1A1CYP3A4TSHR | |
| SCHEMBL29599956 | 0.89 | ALDH1A1 (0.56) | ESR1ESR2ALDH1A1CYP3A4TSHR | |
| SCHEMBL1347496 | 0.89 | ALDH1A1 (0.56) | ESR1ESR2ALDH1A1CYP3A4TSHR | |
| SCHEMBL29446724 | 0.89 | ESR1 (0.63) | ESR1ESR2ALDH1A1CYP3A4TSHR | |
| SCHEMBL177979 | 0.89 | ESR1 (0.63) | ESR1ESR2ALDH1A1CYP3A4TSHR | |
| Phenol SCHEMBL9346557 | 0.86 | ESR1 (0.64) | ESR1ESR2ALDH1A1CYP3A4TSHR | |
| SCHEMBL26968 | 0.86 | ESR1 (1.00) | ESR1ESR2ALDH1A1CYP3A4TSHR | |
| SCHEMBL18635220 | 0.85 | ESR1 (0.69) | ESR1ESR2ALDH1A1CYP3A4TSHR | |
| SCHEMBL18635219 | 0.85 | ESR1 (0.69) | ESR1ESR2ALDH1A1CYP3A4TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0945420-B1 | Process for the preparation of bisphenols | MITSUI CHEMICALS INC (JP) | 2002-06-12 | — | — | EP | disclosed |
| EP-0945420-A1 | Process for the preparation of bisphenols | Mitsui Chemicals, Inc. (JP) | 1999-09-29 | — | — | EP | disclosed |