Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.33 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.33 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.33 |
| ▸ | TTR | P02766 | 1/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5696499 | 0.83 | TSHR (0.45) | TSHRCES2CES1ALDH1A1CYP1A2 | |
| SCHEMBL16954341 | 0.79 | TSHR (0.34) | TSHRCES2CES1ALDH1A1POLB | |
| SCHEMBL16961777 | 0.78 | TSHR (0.33) | TSHRCES2CES1ALDH1A1TAS1R3 | |
| SCHEMBL16954009 | 0.78 | HPGD (0.33) | TSHRCES2CES1ALDH1A1CYP1A2 | |
| SCHEMBL28784207 | 0.77 | TSHR (0.48) | TSHRCES2CES1ALDH1A1CYP1A2 | |
| SCHEMBL10706917 | 0.76 | TSHR (0.58) | TSHRCES2CES1ALDH1A1CYP1A2 | |
| SCHEMBL16960567 | 0.76 | ALDH1A1 (0.35) | ALDH1A1LMNAHPGDMEN1KMT2A | |
| SCHEMBL7596116 | 0.76 | ALDH1A1 (0.52) | TSHRCES2CES1ALDH1A1CYP1A2 | |
| SCHEMBL2303377 | 0.76 | TSHR (0.63) | TSHRCES2CES1ALDH1A1CYP1A2 | |
| SCHEMBL1431970 | 0.75 | CES2 (0.56) | TSHRCES2CES1ALDH1A1CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |