Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | KDM1A | O60341 | 3/20 | 0.47 |
| ▸ | MAOA | P21397 | 3/20 | 0.47 |
| ▸ | MAOB | P27338 | 3/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10400090 | 0.85 | KDM1A (0.52) | ALDH1A1MAPTALOX12LMNAL3MBTL1 | |
| SCHEMBL10399481 | 0.81 | GRIN1 (0.54) | ALDH1A1MAPTALOX12KDM1AMAOA | |
| SCHEMBL10399768 | 0.81 | TAOK1 (0.55) | SMN1; SMN2CYP1A2CYP2C19NPC1RAB9A | |
| SCHEMBL10398567 | 0.79 | ADRA1A (0.49) | MAPTDRD2CA1CA2ACHE | |
| SCHEMBL12614692 | 0.77 | LTA4H (0.55) | MAPTLMNAL3MBTL1KDM1AMAOA | |
| SCHEMBL10398571 | 0.76 | CYP1A2 (0.50) | ALDH1A1MAPTLMNAL3MBTL1MAOA | |
| Hydrochloric Acid SCHEMBL27903791 | 0.76 | LTA4H (0.54) | MAPTLMNAL3MBTL1KDM1AMAOA | |
| SCHEMBL24733396 | 0.75 | DRD2 (0.74) | DRD2CA1CA2ACHE | |
| SCHEMBL10399771 | 0.75 | AR (0.50) | ALDH1A1MAPTALOX12LMNAL3MBTL1 | |
| SCHEMBL7042985 | 0.71 | MAOB (0.62) | LMNAKDM1AMAOAMAOBSMN1; SMN2 |
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-4975461-A | Enzymes/oxidoreductases/inhibitors | E. R. SQUIBB & SONS, INC. (US) | 1990-12-04 | — | — | US | disclosed |