Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 4/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL22325019 | 0.76 | HPGD (0.44) | NPC1SMN1; SMN2HPGDRAB9ATP53 | |
| SCHEMBL1104672 | 0.74 | SMN1; SMN2 (0.52) | NPC1SMN1; SMN2HPGDRAB9ATP53 | |
| SCHEMBL4424126 | 0.71 | ALDH1A1 (0.43) | SMN1; SMN2MAPK1ALDH1A1LMNAGAA | |
| SCHEMBL10162463 | 0.71 | PDE3B (0.44) | NPC1SMN1; SMN2HPGDRAB9ATP53 | |
| SCHEMBL18509218 | 0.71 | HPGD (0.49) | NPC1SMN1; SMN2HPGDRAB9ATP53 | |
| SCHEMBL12497560 | 0.71 | SLC6A2 (0.60) | DPP4 | |
| SCHEMBL8257644 | 0.71 | LGMN (0.50) | NPC1SMN1; SMN2HPGDRAB9ATP53 | |
| SCHEMBL6508133 | 0.70 | HTT (0.45) | NPC1RAB9AHTTKMT2AGAA | |
| SCHEMBL1239172 | 0.70 | ALDH1A1 (0.44) | NPC1SMN1; SMN2HPGDRAB9ATP53 | |
| SCHEMBL3591892 | 0.69 | RPS6KB1 (0.43) | DPP4 |
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-2005058885-A2 | PIPERIDINE DERIVATIVES AND THEIR USE AS GLYCINE TRANSPORTER INHIBITORS | GLAXO GROUP LIMITED (GB) | 2005-06-30 | — | — | WO | disclosed |