Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.34 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | MMP12 | P39900 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | MMP14 | P50281 | 1/20 | 0.32 |
| ▸ | MMP16 | P51512 | 1/20 | 0.32 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | FAAH | O00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL8370535 | 0.82 | TYR (0.36) | CYP1A2CYP3A4ALDH1A1MMP1MMP2 | |
| SCHEMBL8369682 | 0.80 | ESR1 (0.41) | CYP1A2ESR2CYP3A4ALDH1A1ESR1 | |
| SCHEMBL8367583 | 0.79 | TYR (0.41) | CYP1A2CYP3A4ALDH1A1MMP1MMP2 | |
| SCHEMBL8365824 | 0.79 | TYR (0.42) | CYP1A2CYP3A4ALDH1A1MMP1MMP2 | |
| SCHEMBL8370555 | 0.76 | TYR (0.41) | CYP1A2ESR2CYP3A4ALDH1A1ESR1 | |
| SCHEMBL8370471 | 0.75 | ESR2 (0.36) | CYP1A2ESR2CYP3A4ALDH1A1ESR1 | |
| SCHEMBL8370537 | 0.73 | TYR (0.40) | CYP1A2ESR2CYP3A4ALDH1A1ESR1 | |
| SCHEMBL10775084 | 0.72 | GABRA1 (0.53) | CYP1A2ESR2CYP3A4ALDH1A1ESR1 | |
| SCHEMBL8365989 | 0.72 | TRPA1 (0.40) | CYP1A2CYP3A4ALDH1A1LMNAHPGD | |
| SCHEMBL10599648 | 0.72 | CRHBP (0.40) | CYP1A2ESR2CYP3A4ALDH1A1ESR1 |
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 |