Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.43 |
| ▸ | RORC | P51449 | 1/20 | 0.43 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | GCK | P35557 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9034923 | 0.81 | PTGS2 (0.55) | PTGS2KMT2APARP10MMP3GCK | |
| SCHEMBL3796352 | 0.81 | PTGS2 (0.47) | PTGS2KMT2APARP10RORCMMP3 | |
| SCHEMBL6184286 | 0.81 | EPHX2 (0.54) | PTGS2AKR1C3AKR1C2 | |
| SCHEMBL17230485 | 0.79 | PTGS2 (0.56) | PTGS2KMT2APARP10RORCGCK | |
| SCHEMBL21540974 | 0.76 | PTGS2 (0.51) | PTGS2KMT2APARP10MMP3GCK | |
| SCHEMBL6509115 | 0.75 | AKR1C3 (0.43) | PTGS2KMT2AAKR1C3AKR1C2MEN1 | |
| SCHEMBL5146326 | 0.74 | PTGS2 (0.52) | PTGS2KMT2AAKR1C3AKR1C2MEN1 | |
| SCHEMBL16162246 | 0.73 | MEN1 (0.58) | PTGS2KMT2APARP10AKR1C3AKR1C2 | |
| SCHEMBL11642600 | 0.73 | AKR1C3 (0.63) | PTGS2AKR1C3AKR1C2 | |
| SCHEMBL8049079 | 0.72 | ENPP2 (0.50) | PTGS2AKR1C3 |
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-2005051941-A1 | THIONE DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | CJ CORPORATION (KR) | 2005-06-09 | — | — | WO | disclosed |