Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 6/20 | 0.51 |
| ▸ | MEN1 | O00255 | 5/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.51 |
| ▸ | CASP1 | P29466 | 1/20 | 0.51 |
| ▸ | BLM | P54132 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 10/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19716807 | 0.89 | ADORA1 (0.53) | ALDH1A1HSD17B10KDM4EPOLBHPGD | |
| SCHEMBL23162717 | 0.77 | ADORA2A (0.53) | ALDH1A1HSD17B10KDM4EPOLBHPGD | |
| SCHEMBL29623216 | 0.77 | ADORA2A (0.53) | ALDH1A1HSD17B10KDM4EPOLBHPGD | |
| SCHEMBL21116577 | 0.73 | ALDH1A1 (0.51) | ALDH1A1HSD17B10KDM4EPOLBHPGD | |
| Ammonia Solution, Strong SCHEMBL19717396 | 0.72 | ADORA1 (0.50) | ALDH1A1HSD17B10KDM4EPOLBHPGD | |
| SCHEMBL6256113 | 0.71 | HSD17B10 (0.72) | ALDH1A1HSD17B10KDM4EPOLBHPGD | |
| SCHEMBL6258393 | 0.71 | ADORA1 (0.61) | ALDH1A1HSD17B10KDM4EPOLBHPGD | |
| SCHEMBL6440893 | 0.71 | ADORA2A (0.68) | ALDH1A1HSD17B10KDM4EPOLBHPGD | |
| SCHEMBL22889894 | 0.70 | ALDH1A1 (0.46) | ALDH1A1HSD17B10KDM4EPOLBHPGD | |
| SCHEMBL6441030 | 0.70 | KDM4E (0.75) | ALDH1A1HSD17B10KDM4EPOLBHPGD |
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-2017216726-A1 | SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2017-12-21 | — | — | WO | disclosed |
| WO-2017216727-A1 | SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2017-12-21 | — | — | WO | disclosed |