Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.53 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.53 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.50 |
| ▸ | PDE4A | P27815 | 2/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ABHD16A | O95870 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL12253490 | 0.85 | NPC1 (0.72) | SMN1; SMN2NPC1RAB9AALDH1A1LMNA | |
| SCHEMBL29218170 | 0.84 | FGFR1 (0.53) | SMN1; SMN2NPC1RAB9APDE4BPDE4D | |
| SCHEMBL29369460 | 0.82 | ALDH1A1 (0.53) | SMN1; SMN2NPC1RAB9APDE4BPDE4D | |
| SCHEMBL24934089 | 0.81 | SMN1; SMN2 (0.53) | SMN1; SMN2NPC1RAB9APDE4BPDE4D | |
| SCHEMBL10315082 | 0.76 | MAPK1 (0.62) | SMN1; SMN2NPC1RAB9A | |
| SCHEMBL11333428 | 0.75 | RAB9A (0.62) | SMN1; SMN2NPC1RAB9APDE4BPDE4D | |
| SCHEMBL28698469 | 0.74 | MAPT (0.70) | SMN1; SMN2NPC1RAB9APDE4BPDE4D | |
| SCHEMBL2197462 | 0.74 | PDE4B (0.73) | SMN1; SMN2NPC1RAB9APDE4BPDE4D | |
| SCHEMBL11441836 | 0.73 | SMN1; SMN2 (0.55) | SMN1; SMN2NPC1RAB9APDE4BPDE4D | |
| SCHEMBL15331490 | 0.73 | SMN1; SMN2 (0.53) | SMN1; SMN2NPC1RAB9APDE4BPDE4D |
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-2023009475-A1 | ROCK2 INHIBITORS AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2023-02-02 | — | — | WO | disclosed |