Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 1/20 | 0.50 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.50 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.46 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | AVPR1A | P37288 | 3/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL613390 | 0.91 | SMN1; SMN2 (0.47) | USP2CYP1A2CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL615559 | 0.88 | SMN1; SMN2 (0.45) | USP2CYP1A2CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL613549 | 0.88 | TP53 (0.47) | USP2PIK3CDPIK3R1PIK3CAPIK3CG | |
| SCHEMBL615054 | 0.86 | AVPR1A (0.51) | USP2CYP1A2CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL615567 | 0.86 | SMN1; SMN2 (0.53) | USP2CYP1A2CYP2C19NPSR1PIK3CD | |
| SCHEMBL613033 | 0.85 | AVPR1A (0.51) | USP2CYP1A2CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL615036 | 0.85 | TP53 (0.45) | USP2PIK3CDPIK3R1PIK3CAPIK3CG | |
| SCHEMBL613100 | 0.84 | AVPR1A (0.63) | USP2CYP1A2CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL614430 | 0.84 | AVPR1A (0.60) | USP2NPSR1PIK3CDPIK3R1PIK3CA | |
| SCHEMBL613537 | 0.84 | SMN1; SMN2 (0.49) | USP2NPSR1PIK3CDPIK3R1PIK3CA |
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-1917255-A2 | INDOL-3-YL-CARBONYL-PIPERIDIN AND PIPERAZIN DERIVATIVES | F. Hoffmann-Roche AG (CH) | 2008-05-07 | — | — | EP | disclosed |
| WO-2007014851-A2 | INDOL-3-YL-CARBONYL-PIPERIDIN AND PIPERAZIN DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2007-02-08 | — | — | WO | disclosed |