Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.52 |
| ▸ | TACR2 | P21452 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | FDPS | P14324 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | VCP | P55072 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4591361 | 0.83 | ALDH1A1 (0.44) | ALDH1A1TACR2HPGDTDP1L3MBTL1 | |
| SCHEMBL2960690 | 0.77 | ALDH1A1 (0.55) | ALDH1A1TACR2HPGDTDP1L3MBTL1 | |
| SCHEMBL12087983 | 0.77 | VCP (0.38) | DHFRVCPCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3403159 | 0.76 | ADRA1A (0.58) | ALDH1A1HPGDNPSR1KDM4EVCP | |
| SCHEMBL18519805 | 0.75 | ALDH1A1 (0.47) | ALDH1A1MAPTKDM4ECYP1A2CYP3A4 | |
| SCHEMBL2599782 | 0.74 | ALDH1A1 (0.51) | ALDH1A1TACR2HPGDTDP1L3MBTL1 | |
| SCHEMBL17535846 | 0.74 | ALDH1A1 (0.58) | ALDH1A1TACR2HPGDTDP1L3MBTL1 | |
| SCHEMBL2955584 | 0.74 | ALDH1A1 (0.58) | ALDH1A1TACR2HPGDTDP1L3MBTL1 | |
| SCHEMBL493684 | 0.73 | ALDH1A1 (0.73) | ALDH1A1TACR2HPGDTDP1L3MBTL1 | |
| SCHEMBL30159697 | 0.73 | ALDH1A1 (0.73) | ALDH1A1TACR2HPGDTDP1L3MBTL1 |
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-1893603-A1 | PIPERIDIN-4-YL-AMIDE DERIVATIVES AND THEIR USE AS SST RECEPTOR SUBTYPE 5 ANTAGONISTS | F. Hoffmann-La Roche AG (CH) | 2008-03-05 | — | — | EP | disclosed |
| WO-2006128803-A1 | PIPERIDIN-4-YL-AMIDE DERIVATIVES AND THEIR USE AS SST RECEPTOR SUBTYPE 5 ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-12-07 | — | — | WO | disclosed |