Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.37 |
| ▸ | DRD4 | P21917 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14641644 | 0.79 | ATAD2 (0.41) | ATAD2HDAC1HDAC8HDAC6BRD4 | |
| SCHEMBL12107604 | 0.76 | ATAD2 (0.39) | ATAD2BRD4CHRM1HPGDHTT | |
| SCHEMBL18421351 | 0.74 | ATAD2 (0.72) | ATAD2HDAC1HDAC8HDAC6BRD4 | |
| SCHEMBL18055285 | 0.72 | ATAD2 (0.36) | ATAD2BRD4CHRM1CHRM2CHRM4 | |
| SCHEMBL3629805 | 0.72 | HTT (0.50) | HPGDHTTSMN1; SMN2CYP1A2ALDH1A1 | |
| SCHEMBL18421420 | 0.70 | GRIN1 (0.51) | ATAD2DRD2DRD4DRD3HTT | |
| SCHEMBL12333092 | 0.69 | REN (0.50) | CHRM1CHRM5DRD2CHRM3HTT | |
| SCHEMBL12110145 | 0.69 | CHRM1 (0.35) | ATAD2BRD4CHRM1CHRM2CHRM4 | |
| SCHEMBL12110391 | 0.69 | GRIN1 (0.34) | ATAD2BRD4CHRM1CHRM2CHRM4 | |
| SCHEMBL3310122 | 0.69 | BRD4 (0.47) | ATAD2HDAC1HDAC6BRD4CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011111817-A1 | BENZAZEPINE COMPOUND | アステラス製薬株式会社 (JP) | 2011-09-15 | — | — | WO | disclosed |