Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 5/20 | 0.39 |
| ▸ | BRS3 | P32247 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7501514 | 0.87 | ALDH1A1 (0.42) | PARP1GSK3BGPR84MEN1KMT2A | |
| SCHEMBL8823589 | 0.87 | TUBB4A (0.50) | PARP1MEN1HPGDKMT2AALDH1A1 | |
| SCHEMBL3839556 | 0.80 | PARP1 (0.39) | PARP1GSK3BGPR84ALDH1A1 | |
| SCHEMBL6920933 | 0.80 | PARP1 (0.44) | PARP1GSK3BHDAC6GPR84ALDH1A1 | |
| SCHEMBL6919860 | 0.79 | PARP1 (0.38) | PARP1GSK3BGPR84ALDH1A1 | |
| SCHEMBL8434256 | 0.74 | ALDH1A1 (0.44) | L3MBTL1HPGDALDH1A1POLB | |
| SCHEMBL7491139 | 0.72 | CTSB (0.44) | L3MBTL1MEN1HPGDKMT2AALDH1A1 | |
| SCHEMBL7300490 | 0.72 | HCAR2 (0.44) | PARP1GSK3BGPR84ALDH1A1 | |
| SCHEMBL6920583 | 0.72 | ALDH1A1 (0.38) | PARP1GSK3BGPR84ALDH1A1 | |
| SCHEMBL3038066 | 0.71 | PARP1 (0.41) | PARP1GPR84ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004074258-A1 | NOVEL SULPHATED IMIDAZOLE DERIVATIVES, METHOD FOR PRODUCTION THEREOF, NOVEL INTERMEDIATES OBTAINED, APPLICATION THEREOF AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE ABOVE | CAILLE JEAN-CLAUDE (FR) | 2004-09-02 | — | — | WO | disclosed |
| EP-0465368-B1 | Sulfur derivatives of imidazole, process for their preparation, intermediates, their use as medicaments, and pharmaceutical compositions containing them | HOECHST MARION ROUSSEL INC (FR) | 1998-05-20 | — | — | EP | disclosed |
| EP-0465368-A1 | Sulfur derivatives of imidazole, process for their preparation, intermediates, their use as medicaments, and pharmaceutical compositions containing them | ROUSSEL UCLAF (FR) | 1992-01-08 | — | — | EP | disclosed |