Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ACLY | P53396 | 1/20 | 0.43 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4787836 | 0.95 | AKR1C3 (0.47) | AKR1C3LMNATDP1ALDH1A1MEN1 | |
| SCHEMBL4787833 | 0.81 | AKR1C3 (0.40) | AKR1C3LMNATDP1ALDH1A1MEN1 | |
| SCHEMBL4788142 | 0.79 | ESR1 (0.50) | AKR1C3LMNATDP1ALDH1A1MEN1 | |
| SCHEMBL4788040 | 0.79 | SMN1; SMN2 (0.41) | AKR1C3LMNATDP1ALDH1A1MEN1 | |
| SCHEMBL4786646 | 0.77 | AKR1C3 (0.41) | AKR1C3LMNAALDH1A1MEN1KMT2A | |
| SCHEMBL5286887 | 0.76 | POLB (0.56) | LMNATDP1ALDH1A1MEN1KMT2A | |
| SCHEMBL4787181 | 0.75 | PKM (0.42) | AKR1C3LMNAALDH1A1MEN1KMT2A | |
| SCHEMBL6445555 | 0.73 | HSD11B1 (0.60) | AKR1C3LMNAMEN1KMT2AAKR1C1 | |
| SCHEMBL6449319 | 0.73 | L3MBTL1 (0.64) | LMNAALDH1A1MEN1KMT2APKM | |
| SCHEMBL3153609 | 0.72 | HTR6 (0.51) | — |
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 |