Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | SCN4A | P35499 | 7/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | SCN1A | P35498 | 2/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.36 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.36 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | SCN7A | Q01118 | 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 | |
|---|---|---|---|---|
| SCHEMBL7786046 | 0.83 | AOC3 (0.36) | CYP3A4CYP2C9AOC3MAPTMEN1 | |
| SCHEMBL7783890 | 0.83 | ALDH1A1 (0.48) | HTR2AHTR2BKCNH2AOC3MAPT | |
| SCHEMBL7779154 | 0.81 | ADRA2B (0.35) | CYP3A4HTR2ASLC6A4HTR2BKCNH2 | |
| SCHEMBL7786322 | 0.81 | ADRB2 (0.38) | CYP2D6CYP1A2CYP3A4NFKB1AOC3 | |
| SCHEMBL8132924 | 0.79 | ALDH1A1 (0.45) | HTR2ASLC6A4HTR2BKCNH2MAPT | |
| SCHEMBL7786029 | 0.77 | ESR1 (0.45) | TSHRCYP2D6LMNACYP1A2CYP3A4 | |
| SCHEMBL16706946 | 0.77 | ALDH1A1 (0.33) | TSHRLMNACYP1A2CYP3A4HTR2B | |
| SCHEMBL16706940 | 0.77 | ALDH1A1 (0.33) | TSHRLMNACYP1A2CYP3A4HTR2B | |
| SCHEMBL8128080 | 0.75 | ADRA2A (0.44) | TSHRALDH1A1ESR1 | |
| SCHEMBL7783868 | 0.74 | RAB9A (0.47) | TSHRCYP2D6LMNACYP1A2HTT |
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-0735142-B1 | Process for producing (R)-styrene oxides | SUMIKA FINE CHEMICALS CO LTD (JP) | 2001-10-24 | — | — | EP | disclosed |
| US-5717116-A | TREATING A MIXTURE OF PHENYLHALOGENOMETHYLCARBINOLS WITH A LIPASE IN THE PRESENCE OF A CARBOXYLATE FOLLOWED BY CYCLIZATION WITH A BASE | SUMIKA FINE CHEMICALS COMPANY, LIMITED (JP) | 1998-02-10 | — | — | US | disclosed |