Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 5/20 | 0.70 |
| ▸ | ADORA3 | P0DMS8 | 7/20 | 0.61 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.59 |
| ▸ | F2 | P00734 | 2/20 | 0.59 |
| ▸ | F12 | P00748 | 2/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3299661 | 0.90 | ADORA1 (0.70) | ADORA1ADORA3ADORA2AF2F12 | |
| SCHEMBL3945635 | 0.89 | ADORA1 (0.60) | ADORA1ADORA3ADORA2AF2F12 | |
| SCHEMBL9566416 | 0.86 | LMNA (0.59) | ADORA1ADORA3F2F12MEN1 | |
| SCHEMBL2623151 | 0.86 | KCNK9 (0.55) | ADORA1ADORA3F2L3MBTL1MEN1 | |
| SCHEMBL25970402 | 0.83 | POLB (0.59) | ADORA1ADORA3ADORA2AL3MBTL1MEN1 | |
| SCHEMBL6498848 | 0.82 | ADORA1 (1.00) | ADORA1ADORA3ADORA2AF2F12 | |
| SCHEMBL2623093 | 0.81 | L3MBTL1 (0.64) | ADORA1ADORA3ADORA2AF2F12 | |
| SCHEMBL22580648 | 0.81 | KMT2A (0.67) | ADORA1ADORA3ADORA2AMEN1KMT2A | |
| SCHEMBL14523614 | 0.80 | F2 (0.56) | ADORA1ADORA3F2F12L3MBTL1 | |
| SCHEMBL7244671 | 0.79 | ALDH1A1 (0.51) | ADORA1ADORA3ADORA2AMEN1KMT2A |
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-0563386-A1 | ANTICANCER COMPOSITION AND COMPOUND | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1993-10-06 | — | — | EP | disclosed |