Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 20/20 | 0.54 |
| ▸ | BRD2 | P25440 | 12/20 | 0.54 |
| ▸ | BRD3 | Q15059 | 12/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | CCL2 | P13500 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL15437286 | 1.00 | BRD4 (0.54) | BRD4BRD2BRD3CYP3A4CYP2D6 | |
| SCHEMBL15437262 | 0.91 | BRD4 (0.49) | BRD4BRD2BRD3CYP3A4CYP2C9 | |
| SCHEMBL13723319 | 0.91 | BRD4 (0.49) | BRD4BRD2BRD3CYP3A4CYP2C9 | |
| SCHEMBL15450356 | 0.90 | BRD4 (0.58) | BRD4BRD2BRD3CYP3A4CYP2D6 | |
| SCHEMBL13724323 | 0.89 | BRD4 (0.63) | BRD4BRD2BRD3CCL2 | |
| SCHEMBL13723722 | 0.89 | BRD4 (0.59) | BRD4BRD2BRD3CCL2 | |
| SCHEMBL15437401 | 0.88 | BRD4 (0.60) | BRD4BRD2BRD3CYP3A4CYP2C9 | |
| SCHEMBL18871994 | 0.88 | BRD4 (0.58) | BRD4BRD2BRD3CCL2 | |
| SCHEMBL15437557 | 0.88 | BRD4 (0.58) | BRD4BRD2BRD3CCL2 | |
| Formic Acid SCHEMBL15437375 | 0.87 | BRD4 (0.55) | BRD4BRD2BRD3CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2699551-A1 | TETRAHYDROQUINOLINE DERIVATIVES USEFUL AS BROMODOMAIN INHIBITORS | Glaxosmithkline LLC (US) | 2014-02-26 | — | — | EP | disclosed |
| WO-2012143415-A1 | TETRAHYDROQUINOLINE DERIVATIVES USEFUL AS BROMODOMAIN INHIBITORS | GLAXOSMITHKLINE LLC (US) | 2012-10-26 | — | — | WO | disclosed |