Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6141152 | 0.94 | CA1 (0.33) | TSHRCA1CA2 | |
| SCHEMBL6141013 | 0.92 | TSHR (0.37) | TSHRCA1CA2 | |
| SCHEMBL6141462 | 0.86 | — | — | |
| SCHEMBL6141433 | 0.72 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL3180047 | 0.69 | ADRB2 (0.39) | CYP3A4ALDH1A1TSHRADRB2ADRB1 | |
| SCHEMBL6141273 | 0.67 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL6160914 | 0.65 | ADRB2 (0.36) | CYP3A4ALDH1A1TSHRADRB2ADRB1 | |
| SCHEMBL9397695 | 0.64 | ADRB2 (0.39) | CYP3A4ALDH1A1TSHRADRB2ADRB1 | |
| SCHEMBL14778086 | 0.64 | MEN1 (0.35) | CYP3A4ALDH1A1TSHRADRB2ADRB1 | |
| SCHEMBL6161200 | 0.64 | MEN1 (0.35) | CYP3A4ALDH1A1TSHRADRB2ADRB1 |
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-1517881-A1 | 4-(3,3-DIHALO-ALLYLOXY)PHENOXY ALKYL DERIVATIVES | Syngenta Participations AG (CH) | 2005-03-30 | — | — | EP | disclosed |
| WO-2004002943-A1 | 4-(3,3-DIHALO-ALLYLOXY)PHENOXY ALKYL DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2004-01-08 | — | — | WO | disclosed |