Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 14/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 13/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | AR | P10275 | 2/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.50 |
| ▸ | TYR | P14679 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | HTR6 | P50406 | 1/20 | 0.50 |
| ▸ | ESRRG | P62508 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.50 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SHBG | P04278 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL6747031 | 0.82 | ESR1 (0.54) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL7539495 | 0.81 | ESR1 (0.48) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL6550822 | 0.80 | ESR1 (0.54) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL8751432 | 0.79 | ESR1 (0.56) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL14411802 | 0.79 | ESR1 (0.56) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL1773215 | 0.79 | ESR1 (0.56) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL7541722 | 0.79 | ESR1 (0.47) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL18884474 | 0.76 | PTPN5 (0.42) | CYP3A4LMNATSHRSLC6A4HSD17B10 | |
| SCHEMBL8579164 | 0.76 | ESR2 (0.57) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL9561475 | 0.76 | ESR1 (0.52) | ESR1ESR2CYP3A4LMNAAR |
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-0796878-A2 | Method for the preparation of ABS moulding compositions | BAYER AG (DE) | 1997-09-24 | — | — | EP | disclosed |
| US-4235596-A | COUPLING DYE TO FABRIC USING EPOXY COMPOUNDS | CIBA-GEIGY CORPORATION (US) | 1980-11-25 | — | — | US | disclosed |