Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | RORB | Q92753 | 9/20 | 0.39 |
| ▸ | VNN1 | O95497 | 2/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL176165 | 0.85 | ALDH1A1 (0.55) | ALDH1A1HSD17B10RORBADORA2AADORA1 | |
| SCHEMBL175366 | 0.82 | ALDH1A1 (0.53) | ALDH1A1HSD17B10RORBADORA2AADORA1 | |
| SCHEMBL175512 | 0.81 | RORB (0.54) | RORCALDH1A1HSD17B10RORBADORA2A | |
| SCHEMBL6288104 | 0.76 | ALDH1A1 (0.69) | ALDH1A1HSD17B10ADORA2A | |
| SCHEMBL174906 | 0.72 | RORB (0.74) | RORCRORBADORA2AADORA1 | |
| SCHEMBL4267596 | 0.70 | ALDH1A1 (0.55) | RORCALDH1A1HSD17B10RORBADORA2A | |
| SCHEMBL175193 | 0.70 | ALDH1A1 (0.52) | RORCALDH1A1HSD17B10RORBADORA2A | |
| SCHEMBL17316360 | 0.68 | KDM1A (0.50) | ALDH1A1HSD17B10KDM1AMMP12MMP13 | |
| SCHEMBL1256197 | 0.68 | ADORA2A (0.49) | ALDH1A1HSD17B10ADORA2AADORA1ADORA3 | |
| SCHEMBL10092885 | 0.67 | RORB (0.70) | RORCRORBADORA2AADORA1ADORA3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012027965-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-03-08 | — | — | WO | disclosed |
| WO-2012027965-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-03-08 | — | — | WO | disclosed |