Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.34 |
| ▸ | RAB9A | P51151 | 6/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PRKDC | P78527 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 2/20 | 0.33 |
| ▸ | VDR | P11473 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22279288 | 0.80 | MAPK1 (0.36) | NPC1RAB9AALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL22279291 | 0.67 | NPC1 (0.42) | NPC1RAB9AMAPTPRKDCMEN1 | |
| SCHEMBL22280597 | 0.66 | HPGD (0.46) | NPC1RAB9AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL12307502 | 0.65 | TP53 (0.41) | NPC1RAB9AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL12307504 | 0.62 | ALOX5 (0.43) | NPC1RAB9AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL6165586 | 0.62 | NOTUM (0.54) | NPC1RAB9AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL25070007 | 0.62 | ALDH1A1 (0.38) | NPC1RAB9AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL25070393 | 0.62 | ALDH1A1 (0.43) | NPC1RAB9AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL26665257 | 0.61 | KDM4E (0.59) | NPC1RAB9AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL12307582 | 0.61 | NPC1 (0.34) | NPC1RAB9AALDH1A1SMN1; SMN2MAPT |
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-2020153434-A1 | PYRAZOLE COMPOUND | 第一三共株式会社 | 2020-07-30 | — | — | WO | disclosed |