Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 3/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | OXTR | P30559 | 3/20 | 0.36 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.36 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8273444 | 0.84 | ADAM17 (0.49) | — | |
| SCHEMBL8275482 | 0.78 | ADAM17 (0.38) | GAASCN9AKMT2AMEN1 | |
| SCHEMBL8217853 | 0.77 | NAMPT (0.43) | SCN9AALDH1A1 | |
| SCHEMBL16357103 | 0.77 | NAMPT (0.43) | SCN9AALDH1A1 | |
| SCHEMBL1709230 | 0.74 | SCN9A (0.61) | TSHRL3MBTL1ARSCN9AAKR1C3 | |
| SCHEMBL8217842 | 0.71 | ADAM17 (0.63) | — | |
| SCHEMBL8274427 | 0.70 | ADAM17 (0.37) | SCN9A | |
| SCHEMBL8275822 | 0.69 | AKR1C3 (0.53) | TSHRARKMT2AAKR1C3MEN1 | |
| SCHEMBL8273738 | 0.69 | ADAM17 (0.45) | ARAKR1C3ALDH1A1HTTAVPR1A | |
| SCHEMBL8214804 | 0.66 | SMN1; SMN2 (0.44) | TSHRMAPTARKMT2AAKR1C3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005121130-A2 | CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FOR THE TREATMENT OF INFLAMMATORY DISORDERS | SCHERING CORPORATION (US) | 2005-12-22 | — | — | WO | disclosed |