Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.40 |
| ▸ | IDO1 | P14902 | 3/20 | 0.40 |
| ▸ | ACLY | P53396 | 1/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4787181 | 0.87 | PKM (0.42) | AKR1C3IDO1ALDH1A1MEN1KMT2A | |
| SCHEMBL4786646 | 0.85 | AKR1C3 (0.41) | AKR1C3IDO1ALDH1A1MEN1KMT2A | |
| SCHEMBL4788040 | 0.82 | SMN1; SMN2 (0.41) | AKR1C3ALDH1A1MEN1KMT2AAKR1C1 | |
| SCHEMBL4788142 | 0.81 | ESR1 (0.50) | AKR1C3IDO1ACLYTMEM97SIGMAR1 | |
| SCHEMBL4787281 | 0.81 | AKR1C3 (0.47) | AKR1C3ACLYTMEM97SIGMAR1ALDH1A1 | |
| SCHEMBL4787836 | 0.77 | AKR1C3 (0.47) | AKR1C3ACLYALDH1A1MEN1KMT2A | |
| SCHEMBL4787292 | 0.75 | KMT2A (0.46) | IDO1ALDH1A1MEN1KMT2APOLB | |
| SCHEMBL4787431 | 0.74 | IDO1 (0.47) | IDO1ALDH1A1MEN1KMT2APOLB | |
| SCHEMBL5243352 | 0.70 | KMT2A (0.43) | IDO1ALDH1A1MEN1KMT2APOLB | |
| SCHEMBL8160491 | 0.70 | ACLY (0.50) | ACLYALDH1A1MEN1KMT2ALMNA |
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-2008115259-A2 | DERIVATIVES OF BENZOXADIAZOLE SUITABLE FOR THE TREATMENT OF CELL PROLIFERATIVE DISEASES | RIGEL PHARMACEUTICALS, INC. (US) | 2008-09-25 | — | — | WO | claimed |