Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 11/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 11/20 | 0.43 |
| ▸ | PDK3 | Q15120 | 11/20 | 0.43 |
| ▸ | PDK4 | Q16654 | 11/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | BRD2 | P25440 | 1/20 | 0.38 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18871986 | 0.91 | PDK1 (0.42) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL18871778 | 0.88 | LMNA (0.42) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL18871826 | 0.86 | PDK1 (0.44) | PDK1PDK2PDK3PDK4ALDH1A1 | |
| SCHEMBL18871766 | 0.83 | LMNA (0.39) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL30366343 | 0.81 | MAPK1 (0.49) | PDK1PDK2PDK3PDK4ALDH1A1 | |
| SCHEMBL18871774 | 0.80 | BRD4 (0.41) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL20429040 | 0.80 | CNR2 (0.43) | LMNAALDH1A1NPC1HTTRAB9A | |
| SCHEMBL14756003 | 0.79 | BRD4 (0.53) | PDK1PDK2PDK3PDK4ALDH1A1 | |
| SCHEMBL30366396 | 0.78 | BRD4 (0.45) | PDK1PDK2PDK3PDK4ALDH1A1 | |
| SCHEMBL26071758 | 0.78 | BRD4 (0.45) | PDK1PDK2PDK3PDK4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3168213-A1 | TETRAHYDROQUINOLINE DERIVATIVES USEFUL AS BROMODOMAIN INHIBITORS | Glaxosmithkline LLC (US) | 2017-05-17 | — | — | EP | disclosed |