Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 4/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.31 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21363082 | 0.74 | HTT (0.41) | HTTHPGDSRCPTGS1PTGS2 | |
| SCHEMBL10909378 | 0.72 | HTT (0.62) | HTTHPGDSRCPTGS1PTGS2 | |
| SCHEMBL17887931 | 0.71 | GRIN2D (0.43) | HPGD | |
| SCHEMBL10987403 | 0.69 | HAO1 (0.40) | HPGDPTGS1PTGS2ALDH1A1MEN1 | |
| SCHEMBL24804434 | 0.68 | HTT (0.50) | HTTHPGDSRCPTGS1PTGS2 | |
| SCHEMBL18123531 | 0.68 | CYP19A1 (0.47) | PTGS2ALDH1A1CYP3A4AKR1C3 | |
| SCHEMBL900649 | 0.68 | PDE2A (0.47) | HPGDMEN1KMT2AHTR2AHTR2C | |
| SCHEMBL11469504 | 0.67 | HTT (0.41) | HTTHPGDSRCPTGS1PTGS2 | |
| SCHEMBL900763 | 0.67 | HTR2A (0.35) | FFAR4FFAR1HTR2AHTR2CHTR2B | |
| SCHEMBL12828097 | 0.66 | CYP3A4 (0.36) | HPGDMEN1KMT2ACYP1A2CYP3A4 |
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-2460802-A1 | TRIFLUOROMETHYLTHIOPHENIUM DERIVATIVE SALTS, PROCESS FOR PRODUCITON THEREOF, AND PROCESS FOR PRODUCTION OF TRIFLUOROMETHYL-CONTAINING COMPOUNDS USING SAME | Nagoya Institute of Technology (JP) | 2012-06-06 | — | — | EP | disclosed |