Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 3/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19642981 | 0.85 | PPARG (0.49) | CYP2D6CYP2C19KMT2APPARGPPARA | |
| SCHEMBL6300479 | 0.81 | TSHR (0.54) | CYP2C19KMT2AHDAC1HDAC3HDAC4 | |
| SCHEMBL15150399 | 0.79 | LMNA (0.49) | CYP2D6CYP2C19KMT2APPARGPPARA | |
| SCHEMBL844392 | 0.78 | CYP2D6 (0.55) | CYP2D6CYP2C19KMT2APPARGPPARA | |
| SCHEMBL440638 | 0.78 | POLB (0.58) | CYP2D6CYP2C19KMT2APPARGPPARA | |
| SCHEMBL1904189 | 0.78 | CYP2D6 (0.55) | CYP2D6CYP2C19KMT2APPARGPPARA | |
| SCHEMBL31490354 | 0.78 | POLB (0.58) | CYP2D6CYP2C19KMT2APPARGPPARA | |
| SCHEMBL19656729 | 0.77 | KMT2A (0.50) | CYP2D6CYP2C19KMT2APPARGPPARA | |
| SCHEMBL17087579 | 0.77 | PPARG (0.41) | CYP2D6CYP2C19KMT2APPARGPPARA | |
| SCHEMBL2236655 | 0.76 | PPARG (0.50) | CYP2D6CYP2C19KMT2APPARGPPARA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008045671-A1 | MATRIX METALLOPROTEASE INHIBITORS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2008-04-17 | — | — | WO | disclosed |