Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 14/20 | 0.50 |
| ▸ | BRD2 | P25440 | 9/20 | 0.50 |
| ▸ | BRD3 | Q15059 | 7/20 | 0.50 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | ERN1 | O75460 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL15314278 | 0.87 | BRD4 (0.50) | BRD4BRD2BRD3NR3C1ACHE | |
| SCHEMBL16896898 | 0.84 | BRD4 (0.48) | BRD4BRD2BRD3NR3C1ERN1 | |
| SCHEMBL24214434 | 0.82 | BRD4 (0.46) | BRD4BRD2BRD3NR3C1CYP1A2 | |
| SCHEMBL17833812 | 0.80 | BRD4 (0.53) | BRD4BRD2BRD3NR3C1CYP1A2 | |
| SCHEMBL14712715 | 0.80 | BRD4 (0.52) | BRD4BRD2BRD3NR3C1ERN1 | |
| SCHEMBL1906132 | 0.75 | BRD4 (0.48) | BRD4BRD2BRD3NR3C1ERN1 | |
| SCHEMBL19422785 | 0.75 | BRD4 (0.50) | BRD4BRD2BRD3NR3C1ERN1 | |
| SCHEMBL1907803 | 0.75 | BRD4 (0.48) | BRD4BRD2BRD3NR3C1ERN1 | |
| SCHEMBL9938324 | 0.74 | ACHE (0.68) | ACHECYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL1907809 | 0.74 | BRD4 (0.48) | BRD4BRD2BRD3NR3C1CYP1A2 |
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-2017001733-A1 | BICYCLIC HETEROCYCLE DERIVATIVES AS BROMODOMAIN INHIBITORS | ORION CORPORATION (FI) | 2017-01-05 | — | — | WO | disclosed |