Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL2522149 | 0.85 | TSHR (0.44) | GABRA1GABRB2TSHRALDH1A1TDP1 | |
| SCHEMBL4583252 | 0.82 | GABRA1 (0.43) | GABRA1GABRB2TSHRACHEALDH1A1 | |
| SCHEMBL5150512 | 0.80 | GABRA1 (0.42) | GABRA1GABRB2TSHRACHEALDH1A1 | |
| SCHEMBL3641431 | 0.80 | GABRA1 (0.42) | GABRA1GABRB2TSHRACHEALDH1A1 | |
| SCHEMBL4352221 | 0.79 | TSHR (0.41) | GABRA1GABRB2TSHRACHEALDH1A1 | |
| SCHEMBL18525388 | 0.79 | CA2 (0.41) | GABRA1GABRB2TSHRALDH1A1TDP1 | |
| SCHEMBL28512426 | 0.77 | TSHR (0.39) | GABRA1GABRB2TSHRACHEALDH1A1 | |
| SCHEMBL30634176 | 0.77 | TAAR1 (0.52) | GABRA1GABRB2TSHRACHEALDH1A1 | |
| SCHEMBL17051291 | 0.77 | ALDH1A1 (0.38) | GABRA1GABRB2TSHRALDH1A1TDP1 | |
| SCHEMBL10608288 | 0.77 | TAAR1 (0.52) | GABRA1GABRB2TSHRACHEALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2398809-B1 | NOVEL SPIRO COMPOUNDS USEFUL AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE | MERCK CANADA INC (CA) | 2015-07-08 | — | — | EP | disclosed |
| EP-2618856-A1 | DEODORANT COMPOSITION FOR SULFIDES | Takasago International Corporation (JP) | 2013-07-31 | — | — | EP | disclosed |
| WO-2012039516-A1 | DEODORANT COMPOSITION FOR SULFIDES | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2012-03-29 | — | — | WO | disclosed |