Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.50 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | GPR68 | Q15743 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30468191 | 0.84 | SMN1; SMN2 (0.71) | SMN1; SMN2ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL17046876 | 0.84 | SMN1; SMN2 (0.71) | SMN1; SMN2ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL9566504 | 0.77 | SMN1; SMN2 (0.63) | SMN1; SMN2ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL669913 | 0.74 | SMN1; SMN2 (0.59) | SMN1; SMN2ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL30262243 | 0.74 | SMN1; SMN2 (1.00) | SMN1; SMN2ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL29808150 | 0.74 | HSP90AA1 (0.69) | SMN1; SMN2ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL29803060 | 0.74 | SMN1; SMN2 (0.59) | SMN1; SMN2ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL664072 | 0.74 | SMN1; SMN2 (1.00) | SMN1; SMN2ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL2490905 | 0.74 | HSP90AA1 (0.69) | SMN1; SMN2ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL3894503 | 0.74 | HSP90AA1 (0.71) | SMN1; SMN2ADORA2AADORA1ADORA3ADORA2B |
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 |