Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 11/20 | 0.74 |
| ▸ | TP53 | P04637 | 3/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.65 |
| ▸ | PDE6D | O43924 | 1/20 | 0.65 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.65 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 2/20 | 0.62 |
| ▸ | HPGD | P15428 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL29412012 | 1.00 | CFTR (0.74) | CFTRTP53ALDH1A1PDE6DALDH2 | |
| SCHEMBL28478230 | 0.89 | CFTR (0.63) | CFTRTP53ALDH1A1MAPTHPGD | |
| SCHEMBL29412099 | 0.89 | CFTR (0.63) | CFTRTP53ALDH1A1MAPTHPGD | |
| SCHEMBL15569406 | 0.86 | CFTR (0.72) | CFTRTP53ALDH1A1PDE6DALDH2 | |
| SCHEMBL29412087 | 0.86 | CFTR (0.72) | CFTRTP53ALDH1A1PDE6DALDH2 | |
| SCHEMBL19032793 | 0.85 | CFTR (1.00) | CFTR | |
| SCHEMBL28377078 | 0.83 | CFTR (0.67) | CFTRTP53ALDH1A1PDE6DALDH2 | |
| SCHEMBL7392247 | 0.81 | MAPT (0.56) | CFTRTP53ALDH1A1PDE6DALDH2 | |
| SCHEMBL29412044 | 0.81 | TP53 (1.00) | TP53ALDH1A1PDE6DALDH2ALDH3A1 | |
| SCHEMBL29412022 | 0.81 | CFTR (0.56) | CFTRTP53ALDH1A1MAPTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014027053-A1 | BENZIMIDAZOLES FOR THE TREATMENT OF CANCER | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2014-02-20 | — | — | WO | claimed |
| WO-2014027053-A1 | BENZIMIDAZOLES FOR THE TREATMENT OF CANCER | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2014-02-20 | — | — | WO | disclosed |