Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | GRM6 | O15303 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CDC7 | O00311 | 1/20 | 0.37 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11836185 | 0.83 | GRM6 (0.42) | AKR1C3AKR1C2CASP1GRM6GPR119 | |
| SCHEMBL11790207 | 0.80 | CASP1 (0.47) | AKR1C3AKR1C2CASP1GRM6GPR119 | |
| SCHEMBL11834108 | 0.80 | ALDH1A1 (0.40) | AKR1C3AKR1C2CASP1GRM6GPR119 | |
| SCHEMBL11835413 | 0.80 | PTPN1 (0.42) | CASP1GRM6ALDH1A1MAPTKDM4E | |
| SCHEMBL11837196 | 0.79 | GRM6 (0.41) | AKR1C3AKR1C2CASP1GRM6GPR119 | |
| SCHEMBL11838428 | 0.79 | GRM6 (0.41) | AKR1C3AKR1C2CASP1GRM6GPR119 | |
| SCHEMBL11842029 | 0.79 | GRM6 (0.41) | AKR1C3AKR1C2CASP1GRM6GPR119 | |
| SCHEMBL11836347 | 0.79 | NPC1 (0.49) | CASP1GRM6ALDH1A1MAPTKDM4E | |
| SCHEMBL11837141 | 0.77 | ALDH1A1 (0.43) | AKR1C3AKR1C2CASP1GRM6ALDH1A1 | |
| SCHEMBL11827580 | 0.77 | ALDH1A1 (0.43) | AKR1C3AKR1C2CASP1GRM6ALDH1A1 |
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-3966801-A | ANTIINFLAMMATORY AGENTS | WILLIAM H. RORER, INC. (US) | 1976-06-29 | — | — | US | disclosed |