Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 7/20 | 0.54 |
| ▸ | HRH1 | P35367 | 7/20 | 0.54 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.54 |
| ▸ | ACKR3 | P25106 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | PDE6D | O43924 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL15567155 | 0.86 | SIGMAR1 (0.65) | CYP2D6HRH1CHRM1MAPTMEN1 | |
| SCHEMBL15569117 | 0.84 | MEN1 (0.48) | CYP2D6HRH1CHRM1MAPTMEN1 | |
| SCHEMBL15568307 | 0.84 | KMT2A (0.59) | CYP2D6HRH1CHRM1MAPTALDH1A1 | |
| SCHEMBL15568581 | 0.82 | HRH1 (0.49) | CYP2D6HRH1CHRM1MAPTMEN1 | |
| SCHEMBL31633065 | 0.82 | HRH1 (0.55) | CYP2D6HRH1CHRM1MAPTHTT | |
| SCHEMBL15567597 | 0.82 | HRH1 (0.54) | CYP2D6HRH1CHRM1HTTKCNH2 | |
| SCHEMBL31633134 | 0.81 | HRH1 (0.57) | CYP2D6HRH1CHRM1HTTKCNH2 | |
| SCHEMBL15568271 | 0.79 | PDE6D (0.56) | CYP2D6HRH1CHRM1MAPTMEN1 | |
| SCHEMBL15569414 | 0.79 | HRH1 (0.56) | CYP2D6HRH1CHRM1GAAHTT | |
| Trifluoroacetic Acid SCHEMBL15567418 | 0.79 | HRH1 (0.59) | CYP2D6HRH1CHRM1KCNH2SIGMAR1 |
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 |