Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | ACP3 | P15309 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TDO2 | P48775 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29523337 | 0.84 | ACP3 (0.46) | P2RX7ACP3TSHRIDO1TDO2 | |
| SCHEMBL6564259 | 0.84 | ACP3 (0.46) | P2RX7ACP3TSHRIDO1TDO2 | |
| SCHEMBL29522913 | 0.81 | TSHR (0.36) | P2RX7TSHR | |
| SCHEMBL10493638 | 0.81 | TSHR (0.36) | P2RX7TSHR | |
| SCHEMBL1845725 | 0.81 | TSHR (0.36) | P2RX7TSHR | |
| SCHEMBL4204805 | 0.77 | TSHR (0.38) | P2RX7TSHRIDO1 | |
| SCHEMBL10892336 | 0.74 | TSHR (0.41) | TSHR | |
| SCHEMBL3785333 | 0.71 | TSHR (0.50) | TSHRIDO1TDO2 | |
| SCHEMBL11722237 | 0.70 | ALDH1A1 (0.43) | P2RX7TSHRIDO1 | |
| SCHEMBL10968544 | 0.70 | IDO1 (0.36) | P2RX7IDO1TDO2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103274929-B | Preparation method of 2-trifluoromethyl benzoic acid | KINGCHEM LIAONING CHEMICAL CO LTD | 2014-12-17 | — | — | CN | claimed |
| CN-103274929-B | Preparation method of 2-trifluoromethyl benzoic acid | KINGCHEM LIAONING CHEMICAL CO LTD | 2014-12-17 | — | — | CN | disclosed |