Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.63 |
| ▸ | GPR68 | Q15743 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.54 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.54 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | IKBKB | O14920 | 1/20 | 0.46 |
| ▸ | BRAF | P15056 | 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 | |
|---|---|---|---|---|
| SCHEMBL29793563 | 0.87 | ALDH1A1 (0.63) | SMN1; SMN2GPR68ALDH1A1L3MBTL1ADORA2A | |
| SCHEMBL10995283 | 0.87 | ALDH1A1 (0.63) | SMN1; SMN2GPR68ALDH1A1L3MBTL1ADORA2A | |
| SCHEMBL17046876 | 0.87 | SMN1; SMN2 (0.71) | SMN1; SMN2GPR68ALDH1A1L3MBTL1ADORA2A | |
| SCHEMBL30468191 | 0.87 | SMN1; SMN2 (0.71) | SMN1; SMN2GPR68ALDH1A1L3MBTL1ADORA2A | |
| SCHEMBL22409559 | 0.79 | ALOX15 (0.67) | SMN1; SMN2ALDH1A1L3MBTL1ADORA2AADORA3 | |
| SCHEMBL16848494 | 0.79 | SMN1; SMN2 (0.60) | SMN1; SMN2GPR68ALDH1A1L3MBTL1ADORA2A | |
| SCHEMBL8744274 | 0.79 | ALDH1A1 (0.46) | SMN1; SMN2GPR68ALDH1A1L3MBTL1ADORA2A | |
| SCHEMBL475048 | 0.77 | ALDH1A1 (0.60) | SMN1; SMN2GPR68ALDH1A1L3MBTL1ADORA2A | |
| SCHEMBL2490905 | 0.77 | HSP90AA1 (0.69) | SMN1; SMN2ALDH1A1L3MBTL1ADORA2AADORA3 | |
| SCHEMBL664072 | 0.77 | SMN1; SMN2 (1.00) | SMN1; SMN2ALDH1A1ADORA2AADORA3ADORA2B |
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 |