Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 9/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PLAT | P00750 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 3/20 | 0.31 |
| ▸ | GABRP | O00591 | 1/20 | 0.31 |
| ▸ | GABRD | O14764 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL295814 | 0.81 | SLC6A4 (0.51) | SLC6A4SLC6A2SLC6A3KCNH2PIK3CD | |
| SCHEMBL8484844 | 0.81 | SLC6A4 (0.45) | SLC6A4SLC6A2SLC6A3KCNH2PIK3CD | |
| Hydrochloric Acid SCHEMBL8484843 | 0.80 | SLC6A4 (0.44) | SLC6A4SLC6A2SLC6A3KCNH2PIK3CD | |
| SCHEMBL19632137 | 0.79 | SLC6A4 (0.43) | SLC6A4SLC6A2SLC6A3KCNH2PIK3CD | |
| SCHEMBL297266 | 0.77 | SLC6A4 (0.49) | SLC6A4SLC6A2SLC6A3KCNH2PIK3CD | |
| SCHEMBL296666 | 0.77 | SLC6A4 (0.44) | SLC6A4SLC6A2SLC6A3KCNH2PIK3CD | |
| Hydrochloric Acid SCHEMBL3740415 | 0.75 | SLC6A4 (0.48) | SLC6A4SLC6A2SLC6A3KCNH2PIK3CD | |
| SCHEMBL21606270 | 0.72 | SLC6A4 (0.46) | SLC6A4SLC6A2SLC6A3KCNH2PIK3CD | |
| SCHEMBL21606459 | 0.72 | PIK3CD (0.65) | SLC6A4SLC6A2SLC6A3KCNH2PIK3CD | |
| Trifluoroacetic Acid SCHEMBL22797934 | 0.72 | SLC6A4 (0.44) | SLC6A4SLC6A2SLC6A3KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010031713-A1 | SUBSTITUTED PYRROLIDINE-2-CARBOXAMIDES | F. HOFFMANN-LA ROCHE AG (CH) | 2010-03-25 | — | — | WO | claimed |
| EP-2534132-A1 | SUBSTITUTED PYRROLIDINE-2-CARBOXAMIDES | F. Hoffmann-La Roche AG (CH) | 2012-12-19 | — | — | EP | disclosed |
| WO-2010031713-A1 | SUBSTITUTED PYRROLIDINE-2-CARBOXAMIDES | F. HOFFMANN-LA ROCHE AG (CH) | 2010-03-25 | — | — | WO | disclosed |