Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | MET | P08581 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KIT | P10721 | 2/20 | 0.42 |
| ▸ | CKS1B | P61024 | 1/20 | 0.42 |
| ▸ | SKP1 | P63208 | 1/20 | 0.42 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22712090 | 1.00 | ALDH1A1 (0.52) | ALDH1A1MAPTLMNAKCNH2MET | |
| SCHEMBL30323135 | 0.88 | MAPT (0.53) | ALDH1A1MAPTLMNAKCNH2MET | |
| SCHEMBL22712080 | 0.88 | MAPT (0.53) | ALDH1A1MAPTLMNAKCNH2MET | |
| SCHEMBL113495 | 0.87 | ALDH1A1 (0.52) | ALDH1A1MAPTLMNAKCNH2MET | |
| SCHEMBL29968748 | 0.86 | KCNH2 (0.41) | ALDH1A1MAPTLMNAKCNH2MET | |
| SCHEMBL26590306 | 0.86 | PDE10A (0.41) | ALDH1A1MAPTLMNAKCNH2MET | |
| SCHEMBL29969656 | 0.86 | PDE10A (0.41) | ALDH1A1MAPTLMNAKCNH2MET | |
| SCHEMBL26590303 | 0.86 | KCNH2 (0.41) | ALDH1A1MAPTLMNAKCNH2MET | |
| SCHEMBL31410495 | 0.85 | MEN1 (0.53) | ALDH1A1MAPTLMNAKCNH2MET | |
| SCHEMBL29841916 | 0.85 | MEN1 (0.53) | ALDH1A1MAPTLMNAKCNH2MET |
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 |
|---|---|---|---|---|---|---|---|
| CN-110520127-B | Piperidinyl-substituted and piperazinyl-substituted heteroaromatic carboxamides as modulators of GPR6 | 武田药品工业株式会社 | 2023-05-16 | — | — | CN | disclosed |