Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.49 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 7/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MGMT | P16455 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.40 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7018457 | 0.89 | ALDH1A1 (0.64) | ALDH1A1HSD17B10MAPK1SQORADORA1 | |
| SCHEMBL3545741 | 0.84 | RXFP1 (0.55) | ALDH1A1HSD17B10MAPK1SQORADORA1 | |
| SCHEMBL7019882 | 0.78 | SQOR (0.45) | HSD17B10MAPK1SQORADORA1KDM4E | |
| SCHEMBL26010519 | 0.77 | ADORA1 (0.52) | ALDH1A1HSD17B10MAPK1SQORADORA1 | |
| SCHEMBL7024723 | 0.77 | ALDH1A1 (0.67) | ALDH1A1HSD17B10MAPK1SQORADORA1 | |
| SCHEMBL3554945 | 0.76 | ADORA2A (0.52) | ALDH1A1HSD17B10MAPK1SQORADORA1 | |
| SCHEMBL1154965 | 0.75 | HTR1A (0.49) | ALDH1A1SQORKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL7022211 | 0.75 | GSK3A (0.55) | ALDH1A1HSD17B10MAPK1SQORADORA1 | |
| SCHEMBL3550981 | 0.71 | ADORA1 (0.60) | ALDH1A1HSD17B10MAPK1SQORADORA1 | |
| SCHEMBL6442682 | 0.71 | HSD17B10 (0.62) | ALDH1A1HSD17B10MAPK1SQORADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1302463-A1 | MEDICINE COMPRISING DICYANOPYRIDINE DERIVATIVE | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 2003-04-16 | — | — | EP | disclosed |