Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 7/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 7/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.50 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CDC42 | P60953 | 1/20 | 0.47 |
| ▸ | RAC1 | P63000 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL577062 | 0.80 | AKR1C3 (0.42) | AKR1C3AKR1C2PTGS1AKR1C1PTGS2 | |
| SCHEMBL11155116 | 0.77 | AKR1C3 (0.76) | AKR1C3AKR1C2PTGS1AKR1C1PTGS2 | |
| SCHEMBL576750 | 0.77 | PTGS2 (0.56) | PTGS1PTGS2CYP1A2SLC22A6LMNA | |
| SCHEMBL8811015 | 0.76 | AKR1C3 (0.61) | AKR1C3AKR1C2PTGS1AKR1C1PTGS2 | |
| SCHEMBL11157275 | 0.75 | AKR1C3 (0.63) | AKR1C3AKR1C2PTGS1AKR1C1PTGS2 | |
| SCHEMBL577330 | 0.74 | PTGS2 (0.56) | AKR1C3AKR1C2PTGS1PTGS2TSHR | |
| SCHEMBL19776632 | 0.71 | AKR1C3 (0.58) | AKR1C3AKR1C2PTGS1AKR1C1PTGS2 | |
| SCHEMBL5829437 | 0.70 | SLC6A3 (0.48) | AKR1C3AKR1C2PTGS1AKR1C1 | |
| SCHEMBL31170906 | 0.70 | SLC6A3 (0.48) | AKR1C3AKR1C2PTGS1AKR1C1 | |
| SCHEMBL505811 | 0.70 | TDP1 (0.77) | AKR1C3AKR1C2PTGS1PTGS2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2418200-A1 | PHTHALIMIDE DERIVATIVES OF NON-STEROIDAL ANTI-INFLAMMATORY COMPOUNDS AND/OR TNF- MODULATORS, METHOD FOR PRODUCING SAME, PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AND USES THEREOF FOR THE TREATMENT OF INFLAMMATORY DISEASES | EMS S. A. (BR) | 2012-02-15 | — | — | EP | claimed |