Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 4/20 | 0.35 |
| ▸ | CNR2 | P34972 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYTH2 | Q99418 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8369552 | 0.91 | ESR1 (0.43) | ESR1ESR2CYP3A4ALDH1A1NR3C2 | |
| SCHEMBL8365868 | 0.84 | CNR1 (0.40) | ESR1ESR2CYP3A4ALDH1A1NR3C2 | |
| SCHEMBL8370449 | 0.81 | ESR1 (0.40) | ESR1ESR2CYP3A4ALDH1A1NR3C2 | |
| SCHEMBL8369543 | 0.81 | ESR1 (0.40) | ESR1ESR2CYP3A4ALDH1A1NR3C2 | |
| SCHEMBL8541112 | 0.80 | PGAM1 (0.36) | ESR1ESR2CYP3A4ALDH1A1NR3C2 | |
| SCHEMBL9324917 | 0.79 | GLRA3 (0.50) | ESR1ESR2CYP3A4ALDH1A1CNR1 | |
| SCHEMBL8365871 | 0.79 | ESR1 (0.41) | ESR1ESR2CYP3A4ALDH1A1NR3C2 | |
| SCHEMBL8369674 | 0.78 | TSHR (0.44) | ESR1ESR2CYP3A4ALDH1A1NR3C2 | |
| SCHEMBL8368675 | 0.78 | ALDH1A1 (0.38) | ESR1ESR2CYP3A4ALDH1A1NR3C2 | |
| SCHEMBL8369084 | 0.78 | ESR1 (0.38) | ESR1ESR2CYP3A4ALDH1A1NR3C2 |
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 |