Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.54 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.54 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.54 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.54 |
| ▸ | MTOR | P42345 | 1/20 | 0.54 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.54 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.54 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.54 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.54 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.54 |
| ▸ | GMNN | O75496 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14960018 | 0.89 | CYP2D6 (0.54) | CYP1A2CYP2D6MAPK1CYP3A4NFKB1 | |
| SCHEMBL17817490 | 0.83 | ALDH1A1 (0.51) | CYP2D6MAPK1POLBALDH1A1HTT | |
| SCHEMBL18101844 | 0.82 | POLB (0.55) | CYP1A2CYP2D6MAPK1CYP3A4NFKB1 | |
| SCHEMBL10642951 | 0.81 | SIGMAR1 (0.46) | CYP1A2CYP2D6MAPK1CYP3A4NFKB1 | |
| Hydrochloric Acid SCHEMBL10501044 | 0.80 | LMNA (0.45) | CYP1A2CYP2D6MAPK1CYP3A4NFKB1 | |
| SCHEMBL2608083 | 0.80 | POLB (0.47) | CYP2D6POLBALDH1A1HTTTSHR | |
| SCHEMBL17016723 | 0.80 | ALDH1A1 (0.49) | CYP2D6MAPK1POLBALDH1A1HTT | |
| SCHEMBL13460606 | 0.79 | UGCG (0.54) | CYP2D6MAPK1CYP3A4NFKB1MTOR | |
| SCHEMBL7792404 | 0.79 | ALDH1A1 (0.67) | POLBALDH1A1HTTKDM4EMITF | |
| SCHEMBL8223804 | 0.79 | GAA (0.69) | CYP2D6ALDH1A1HTTTSHRHIF1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0576766-A1 | Propanolamine derivatives, their preparation and use | NOVO NORDISK A/S (DK) | 1994-01-05 | — | — | EP | disclosed |