Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | SI | P14410 | 1/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.33 |
| ▸ | PPID | Q08752 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.32 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.32 |
| ▸ | ITGAV | P06756 | 1/20 | 0.32 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Lithium Ion SCHEMBL10955307 | 0.81 | CA12 (0.39) | EGLN1ALDH1A1CYP2D6GAAMGAM | |
| SCHEMBL10952495 | 0.81 | CA12 (0.39) | EGLN1ALDH1A1CYP2D6GAAMGAM | |
| Potassium Ion SCHEMBL10951737 | 0.81 | CA12 (0.43) | EGLN1ALDH1A1CYP2D6GAAMGAM | |
| SCHEMBL28352010 | 0.71 | GAA (0.35) | ALDH1A1CYP2D6SMN1; SMN2GAAMGAM | |
| SCHEMBL21903462 | 0.70 | EGLN1 (0.39) | EGLN1ALDH1A1CYP2D6APEX1MAPT | |
| SCHEMBL27879862 | 0.70 | ALDH1A1 (0.53) | ALDH1A1CYP2D6SMN1; SMN2GAAMGAM | |
| SCHEMBL1912605 | 0.69 | EGLN1 (0.63) | EGLN1ALDH1A1CYP2D6SMN1; SMN2GAA | |
| SCHEMBL7761955 | 0.69 | — | — | |
| SCHEMBL11392568 | 0.69 | — | — | |
| SCHEMBL10963692 | 0.69 | ALDH1A1 (0.52) | ALDH1A1CYP2D6GAAMGAMSI |
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 |
|---|---|---|---|---|---|---|---|
| US-4514293-A | SALTS OF N-CARBOXYALKYL-S-CARBOALKOXY DITHIOCARBAMATES | PHILLIPS PETROLEUM COMPANY A CORP OF DE | 1985-04-30 | — | — | US | disclosed |