Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 10/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 10/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | AR | P10275 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 1/20 | 0.48 |
| ▸ | ESRRG | P62508 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TYR | P14679 | 1/20 | 0.39 |
| ▸ | SHBG | P04278 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6551990 | 0.90 | ESR1 (0.48) | ESR1ESR2CYP3A4HPGDTSHR | |
| SCHEMBL26947 | 0.84 | ESR1 (0.58) | ESR1ESR2CYP3A4HPGDTSHR | |
| SCHEMBL25881 | 0.84 | ESR1 (0.58) | ESR1ESR2CYP3A4HPGDTSHR | |
| Cesium SCHEMBL30136131 | 0.82 | ESR1 (0.56) | ESR1ESR2CYP3A4HPGDTSHR | |
| Bromide SCHEMBL30239808 | 0.82 | ESR1 (0.56) | ESR1ESR2CYP3A4HPGDTSHR | |
| Potassium SCHEMBL30136058 | 0.82 | ESR1 (0.56) | ESR1ESR2CYP3A4HPGDTSHR | |
| SCHEMBL30136074 | 0.82 | ESR1 (0.56) | ESR1ESR2CYP3A4HPGDTSHR | |
| Potassium SCHEMBL30894669 | 0.82 | ESR1 (0.56) | ESR1ESR2CYP3A4HPGDTSHR | |
| Ammonia Solution, Strong SCHEMBL30540302 | 0.82 | ESR1 (0.56) | ESR1ESR2CYP3A4HPGDTSHR | |
| SCHEMBL30384659 | 0.82 | ESR1 (0.56) | ESR1ESR2CYP3A4HPGDTSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4315078-A | Flame retardant flexible polyurethane foam containing finely divided inorganic salt wherein a mold of said salt contains at least five moles of water | THE UPJOHN COMPANY (US) | 1982-02-09 | — | — | US | disclosed |