Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | TDO2 | P48775 | 1/20 | 0.46 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.46 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.36 |
| ▸ | HCAR1 | Q9BXC0 | 4/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.34 |
| ▸ | GABRE | P78334 | 1/20 | 0.34 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24857937 | 0.81 | HCAR1 (0.33) | GABRG2GABRB3GABRA5HCAR1GABRA1 | |
| SCHEMBL4730158 | 0.73 | IDO1 (0.45) | IDO1TDO2IDO2NSD2CES1 | |
| SCHEMBL15144565 | 0.69 | HCAR1 (0.49) | HCAR1 | |
| SCHEMBL27987583 | 0.68 | IDO1 (0.49) | IDO1TDO2IDO2GABRG2GABRB3 | |
| SCHEMBL27987592 | 0.68 | IDO1 (0.45) | IDO1TDO2IDO2HCAR1CES1 | |
| SCHEMBL8558631 | 0.67 | HSD11B1 (0.58) | HCAR1MET | |
| SCHEMBL9885126 | 0.67 | IDO1 (0.68) | IDO1TDO2IDO2 | |
| SCHEMBL27522182 | 0.67 | LMNA (0.40) | GABRG2GABRB3GABRA5 | |
| SCHEMBL28923906 | 0.66 | P2RX7 (0.43) | HCAR1 | |
| SCHEMBL12342913 | 0.66 | CYP3A4 (0.47) | HCAR1GRM5 |
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-2010132352-A2 | SPIRO COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS | XENON PHARMACEUTICALS INC. (CA) | 2010-11-18 | — | — | WO | disclosed |