Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | DHODH | Q02127 | 2/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | HAO2 | Q9NYQ3 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7089418 | 0.82 | AKR1C3 (0.42) | CES2CES1SLC6A4SLC6A3MAPT | |
| SCHEMBL7090146 | 0.80 | SLC6A4 (0.39) | SLC6A4SLC6A3MAPTHTT | |
| SCHEMBL7084396 | 0.78 | PTGS2 (0.53) | PTGS1PTGS2 | |
| SCHEMBL7089475 | 0.76 | AKR1C3 (0.33) | CES2CES1SLC6A4SLC6A3MAPT | |
| SCHEMBL7084405 | 0.74 | ALDH1A1 (0.42) | SLC6A4SLC6A3MAPTLMNASMN1; SMN2 | |
| SCHEMBL7089414 | 0.74 | PTGER2 (0.39) | CES2CES1SLC6A4SLC6A3MAPT | |
| SCHEMBL7085178 | 0.70 | PTGER2 (0.38) | SLC6A4SLC6A3MAPTSMN1; SMN2DHODH | |
| SCHEMBL11627037 | 0.66 | L3MBTL1 (0.50) | CES2CES1MAPTLMNASMN1; SMN2 | |
| SCHEMBL11142513 | 0.66 | POLB (0.54) | MAPTLMNASMN1; SMN2AKR1C3KMT2A | |
| SCHEMBL9720784 | 0.65 | ESR2 (0.43) | HTTGCGR |
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-6426360-B1 | ANTIARTHRITIC AGENTS | G D SEARLE & CO. | 2002-07-30 | — | — | US | disclosed |