Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.55 |
| ▸ | DHODH | Q02127 | 3/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23617086 | 0.87 | TSHR (0.47) | CYP2D6ALDH1A1SMN1; SMN2GLO1DHODH | |
| SCHEMBL26084789 | 0.82 | CYP2D6 (0.56) | CYP2D6ALDH1A1SMN1; SMN2GLO1DHODH | |
| SCHEMBL21786019 | 0.80 | CYP2D6 (0.55) | CYP2D6ALDH1A1SMN1; SMN2GLO1DHODH | |
| SCHEMBL24170700 | 0.80 | CYP2D6 (0.55) | CYP2D6ALDH1A1SMN1; SMN2GLO1DHODH | |
| SCHEMBL26012486 | 0.78 | CYP2D6 (0.62) | CYP2D6ALDH1A1SMN1; SMN2GLO1DHODH | |
| SCHEMBL16159974 | 0.78 | CYP2D6 (0.49) | CYP2D6ALDH1A1SMN1; SMN2GLO1DHODH | |
| SCHEMBL8394432 | 0.77 | GLO1 (0.58) | CYP2D6ALDH1A1SMN1; SMN2GLO1DHODH | |
| SCHEMBL9010495 | 0.77 | CYP2D6 (0.60) | CYP2D6ALDH1A1SMN1; SMN2GLO1DHODH | |
| SCHEMBL10314666 | 0.77 | CYP2D6 (0.71) | CYP2D6ALDH1A1SMN1; SMN2GLO1DHODH | |
| SCHEMBL16152122 | 0.75 | ALDH1A1 (0.42) | CYP2D6ALDH1A1SMN1; SMN2GLO1NPSR1 |
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-5304549-A | Control or prevention of degenerative joint diseases | HOFFMANN-LA ROCHE INC. (US) | 1994-04-19 | — | — | US | disclosed |