Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 12/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6619700 | 0.90 | ITK (0.50) | ITKALDH1A1ACKR3 | |
| SCHEMBL6621403 | 0.88 | ITK (0.48) | ITKACKR3 | |
| SCHEMBL6620631 | 0.88 | ITK (0.48) | ITKACKR3 | |
| SCHEMBL6620130 | 0.81 | ITK (0.42) | ITKALDH1A1 | |
| SCHEMBL6766640 | 0.73 | ITK (0.92) | ITK | |
| SCHEMBL6619252 | 0.66 | PTGER4 (0.48) | ITKALDH1A1MAPT | |
| SCHEMBL15562950 | 0.64 | ITK (0.61) | ITKALDH1A1ACKR3MAPTHTT | |
| SCHEMBL6618857 | 0.64 | MAPT (0.61) | ITKALDH1A1LMNAMAPTHTT | |
| SCHEMBL6771407 | 0.62 | ITK (0.88) | ITK | |
| SCHEMBL31758152 | 0.62 | KDM4E (0.60) | ALDH1A1LMNAHTT |
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-1448199-A1 | BENZIMIDAZOLES USEFUL AS PROTEIN KINASE INHIBITORS | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 2004-08-25 | — | — | EP | disclosed |
| WO-2003041708-A1 | BENZIMIDAZOLES USEFUL AS PROTEIN KINASE INHIBITORS | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2003-05-22 | — | — | WO | disclosed |