Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 8/20 | 0.46 |
| ▸ | ESR1 | P03372 | 6/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | ESRRG | P62508 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8370475 | 0.93 | PTPN1 (0.40) | ESR2ESR1CYP3A4ALDH1A1PTPN1 | |
| SCHEMBL8369553 | 0.84 | ESR2 (0.44) | ESR2ESR1CYP3A4ALDH1A1AR | |
| SCHEMBL8367502 | 0.81 | ESR1 (0.44) | ESR2ESR1CYP3A4ALDH1A1AR | |
| SCHEMBL8367500 | 0.80 | CYP3A4 (0.40) | ESR2ESR1CYP3A4ALDH1A1TSHR | |
| SCHEMBL8516600 | 0.79 | NR3C2 (0.34) | ESR2ESR1CYP3A4ALDH1A1HPGD | |
| SCHEMBL8517188 | 0.78 | ESR2 (0.50) | ESR2ESR1CYP3A4ALDH1A1PTPN1 | |
| SCHEMBL8516572 | 0.78 | HSD17B2 (0.40) | ESR2ESR1CYP3A4ALDH1A1PTPN1 | |
| SCHEMBL8369784 | 0.77 | ESR1 (0.40) | ESR2ESR1CYP3A4ALDH1A1PTPN1 | |
| SCHEMBL8516622 | 0.77 | ESR1 (0.52) | ESR2ESR1MMP3BCL2L1HPGD | |
| SCHEMBL8368763 | 0.77 | PGAM1 (0.38) | ESR2ESR1CYP3A4ALDH1A1TSHR |
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-0714785-B1 | Sulfonated phenol (salt) containing color-developing agents and color-developing sheets | MITSUI CHEMICALS INC (JP) | 1999-01-07 | — | — | EP | disclosed |
| US-5647896-A | MULTIVALENT SALT OF A SALICYLIC ACID DERIVATIVE, SULFONATED PHENOL | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-07-15 | — | — | US | disclosed |
| EP-0714785-A1 | Sulfonated phenol (salt) containing color-developing agents and color-developing sheets | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1996-06-05 | — | — | EP | disclosed |