Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SI | P14410 | 1/20 | 0.39 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | UGT2B7 | P16662 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5682017 | 0.82 | CYP2D6 (0.47) | CYP2D6ALDH1A1NPSR1L3MBTL1THRB | |
| SCHEMBL13681637 | 0.82 | CYP2D6 (0.47) | CYP2D6ALDH1A1NPSR1L3MBTL1THRB | |
| SCHEMBL1866738 | 0.82 | CYP2D6 (0.47) | CYP2D6ALDH1A1NPSR1L3MBTL1THRB | |
| SCHEMBL1245676 | 0.81 | CYP2D6 (0.60) | CYP2D6ALDH1A1NPSR1L3MBTL1THRB | |
| SCHEMBL4818909 | 0.81 | CYP2D6 (0.46) | CYP2D6ALDH1A1NPSR1L3MBTL1THRB | |
| SCHEMBL25251873 | 0.79 | CYP2D6 (0.44) | CYP2D6ALDH1A1NPSR1L3MBTL1THRB | |
| Hydrochloric Acid SCHEMBL7656869 | 0.79 | CYP2D6 (0.44) | CYP2D6ALDH1A1NPSR1L3MBTL1THRB | |
| SCHEMBL2216450 | 0.79 | CYP2D6 (0.51) | CYP2D6ALDH1A1NPSR1L3MBTL1THRB | |
| SCHEMBL4415603 | 0.79 | CYP2D6 (0.44) | CYP2D6ALDH1A1NPSR1L3MBTL1THRB | |
| SCHEMBL22963812 | 0.79 | CYP2D6 (0.47) | CYP2D6ALDH1A1NPSR1L3MBTL1THRB |
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 |
|---|---|---|---|---|---|---|---|
| CN-1276790-A | Carboxamidothiazole derivs., preparation, pharmaceutical composition contg. them | SANOFI SA (FR) | 2000-12-13 | — | — | CN | disclosed |