Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 9/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.41 |
| ▸ | TMIGD3 | P0DMS9 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8188233 | 0.89 | ALDH1A1 (0.51) | SMN1; SMN2ALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL8203016 | 0.85 | ALDH1A1 (0.55) | SMN1; SMN2ALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL8198855 | 0.83 | RAB9A (0.61) | SMN1; SMN2ALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL8190700 | 0.82 | PDE5A (0.47) | SMN1; SMN2ALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL8195845 | 0.77 | ALDH1A1 (0.40) | SMN1; SMN2ALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL31716664 | 0.75 | TNKS2 (0.53) | ALDH1A1MAPTKDM4EBRD4HPGD | |
| SCHEMBL8200741 | 0.75 | TNKS2 (0.53) | ALDH1A1MAPTKDM4EBRD4HPGD | |
| SCHEMBL8195380 | 0.75 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL7058912 | 0.75 | SMN1; SMN2 (0.74) | SMN1; SMN2ALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL8200644 | 0.75 | ALDH1A1 (0.57) | SMN1; SMN2ALDH1A1NPC1MAPTRAB9A |
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-2008063668-A1 | HETEROBICYCLIC METALLOPROTEASE INHIBITORS | ALANTOS PHARMACEUTICALS HOLDING, INC. (US) | 2008-05-29 | — | — | WO | disclosed |