Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8746808 | 0.85 | TSHR (0.50) | TSHRTDP1MAPK1CYP3A4TRPA1 | |
| SCHEMBL30534235 | 0.84 | MEN1 (0.46) | TSHRTDP1MAPK1CYP3A4ALDH1A1 | |
| SCHEMBL58769 | 0.84 | MEN1 (0.46) | TSHRTDP1MAPK1CYP3A4ALDH1A1 | |
| SCHEMBL11782324 | 0.76 | TSHR (0.35) | TSHRTDP1MAPK1CYP3A4TRPA1 | |
| SCHEMBL785906 | 0.76 | TDP1 (0.50) | TSHRTDP1MAPK1CYP3A4TRPA1 | |
| SCHEMBL29507682 | 0.76 | TDP1 (0.50) | TSHRTDP1MAPK1CYP3A4TRPA1 | |
| SCHEMBL10791968 | 0.76 | CYP3A4 (0.34) | TSHRTDP1CYP3A4TRPA1ALDH1A1 | |
| SCHEMBL10787546 | 0.75 | CYP3A4 (0.33) | TSHRTDP1CYP3A4TRPA1ALDH1A1 | |
| SCHEMBL10788053 | 0.75 | TSHR (0.35) | TSHRTDP1MAPK1CYP3A4ALDH1A1 | |
| SCHEMBL29365125 | 0.75 | TDP1 (0.70) | TSHRTDP1MAPK1CYP3A4TRPA1 |
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-0152310-B1 | PROCESS FOR THE PREPARATION OF TRIFLUOROMETHYL ANILINES | RHONE-POULENC CHIMIE (FR) | 1987-07-22 | — | — | EP | disclosed |
| EP-0152310-A1 | Process for the preparation of trifluoromethyl anilines | RHONE-POULENC CHIMIE (FR) | 1985-08-21 | — | — | EP | disclosed |