Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL589550 | 0.88 | MAOA (0.43) | PARP1ALDH1A1CYP2D6 | |
| SCHEMBL3276264 | 0.77 | KDM4E (0.46) | PARP1ALDH1A1HTTL3MBTL1POLB | |
| SCHEMBL3540865 | 0.76 | PARP1 (0.43) | PARP1ALDH1A1HTTPOLBMEN1 | |
| SCHEMBL19207191 | 0.75 | HRH3 (0.45) | ALDH1A1HTTL3MBTL1CYP2D6MEN1 | |
| SCHEMBL3531247 | 0.71 | ALDH1A1 (0.50) | ALDH1A1HTTKMT2A | |
| SCHEMBL25335598 | 0.71 | SLC6A2 (0.59) | — | |
| SCHEMBL7057566 | 0.71 | CHRNB4 (0.57) | — | |
| SCHEMBL25336072 | 0.70 | SLC6A2 (0.57) | — | |
| SCHEMBL591173 | 0.70 | NOS3 (0.39) | ALDH1A1L3MBTL1POLBKMT2A | |
| SCHEMBL1830606 | 0.70 | POLB (0.49) | ALDH1A1HTTL3MBTL1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1401831-A1 | INDAZOLE BENZIMIDAZOLE COMPOUNDS AS TYROSINE AND SERINE/THREONINE KINASE INHIBITORS | CHIRON CORPORATION (US) | 2004-03-31 | — | — | EP | disclosed |
| WO-2003004488-A1 | INDAZOLE BENZIMIDAZOLE COMPOUNDS AS TYROSINE AND SERINE/THREONINE KINASE INHIBITORS | CHIRON CORPORATION (US) | 2003-01-16 | — | — | WO | disclosed |