Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | BRD4 | O60885 | 10/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | BRD2 | P25440 | 7/20 | 0.46 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | BRD3 | Q15059 | 3/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18249913 | 0.81 | ALDH1A1 (0.52) | ALDH1A1CYP1A2CYP3A4HSD17B10MAPK1 | |
| SCHEMBL18249950 | 0.79 | ALDH1A1 (0.51) | ALDH1A1CYP1A2CYP3A4HSD17B10MAPK1 | |
| SCHEMBL3862485 | 0.79 | ALDH1A1 (0.74) | ALDH1A1CYP1A2CYP3A4HSD17B10MAPK1 | |
| SCHEMBL12095439 | 0.74 | BRD4 (0.55) | CYP3A4BRD4HDAC1BRD2CREBBP | |
| SCHEMBL16619434 | 0.73 | ALDH1A1 (0.42) | ALDH1A1CYP1A2CYP3A4HSD17B10MAPK1 | |
| SCHEMBL12095520 | 0.73 | BRD4 (0.57) | ALDH1A1CYP1A2CYP3A4RAB9ABRD4 | |
| SCHEMBL19850569 | 0.72 | ALDH1A1 (1.00) | ALDH1A1CYP1A2CYP3A4HSD17B10MAPK1 | |
| SCHEMBL2172236 | 0.72 | ALDH1A1 (0.70) | ALDH1A1CYP1A2CYP3A4HSD17B10MAPK1 | |
| SCHEMBL2369281 | 0.72 | ALDH1A1 (0.69) | ALDH1A1CYP1A2CYP3A4HSD17B10MAPK1 | |
| SCHEMBL5217248 | 0.71 | BRD4 (0.58) | ALDH1A1CYP1A2CYP3A4RAB9ABRD4 |
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-2015049629-A1 | IMIDAZOQUINOLINE COMPOUNDS AS BROMODOMAIN INHIBITORS | Piramal Enterprises Limited (IN) | 2015-04-09 | — | — | WO | disclosed |