Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GBA1 | P04062 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MET | P08581 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.40 |
| ▸ | KDM6B | O15054 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL3162285 | 0.93 | HRH4 (0.44) | SIGMAR1HRH4MEN1KMT2AALDH1A1 | |
| SCHEMBL3177354 | 0.92 | KMT2A (0.49) | SIGMAR1MEN1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL3170848 | 0.89 | GBA1 (0.52) | HRH4KMT2AALDH1A1GBA1ADORA2B | |
| SCHEMBL3155851 | 0.88 | MAPT (0.53) | HRH4MEN1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL3174442 | 0.88 | GBA1 (0.47) | HRH4ALDH1A1GBA1MAPTADORA2B | |
| SCHEMBL3176827 | 0.87 | TSHR (0.49) | SIGMAR1MEN1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL3172646 | 0.86 | GBA1 (0.48) | HRH4KMT2AALDH1A1L3MBTL1GBA1 | |
| SCHEMBL3166317 | 0.85 | ITGB2 (0.53) | MEN1KMT2AALDH1A1L3MBTL1MAPT | |
| SCHEMBL3166308 | 0.85 | ITGB2 (0.53) | MEN1KMT2AALDH1A1L3MBTL1MAPT | |
| SCHEMBL3176585 | 0.85 | GBA1 (0.43) | ALDH1A1GBA1MAPTADORA2BKDM6B |
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-1465631-B1 | PYRIMIDINE A2B SELECTIVE ANTAGONIST COMPOUNDS, THEIR SYNTHESIS AND USE | OSI PHARM INC (US) | 2010-02-24 | — | — | EP | disclosed |