Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | CD74 | P04233 | 1/20 | 0.46 |
| ▸ | MIF | P14174 | 1/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | LPO | P22079 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7090220 | 0.79 | ADORA2A (0.50) | ALDH1A1MEN1KMT2ATSHRADORA2A | |
| SCHEMBL6693887 | 0.77 | MEN1 (0.60) | ALDH1A1MEN1KMT2APKMTSHR | |
| SCHEMBL25380503 | 0.77 | GPR55 (0.50) | ALDH1A1MEN1KMT2APKMHDAC1 | |
| SCHEMBL28019857 | 0.76 | MEN1 (0.55) | ALDH1A1MEN1KMT2APKMHDAC1 | |
| SCHEMBL19086943 | 0.75 | ALDH1A1 (0.67) | ALDH1A1MEN1KMT2AHDAC1HDAC7 | |
| SCHEMBL22349826 | 0.72 | ALDH1A1 (0.49) | ALDH1A1MEN1KMT2AADORA2AADORA1 | |
| SCHEMBL28019780 | 0.72 | MEN1 (0.50) | ALDH1A1MEN1KMT2APKMHDAC1 | |
| SCHEMBL29623271 | 0.71 | ADORA2A (0.58) | ALDH1A1ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL17316399 | 0.70 | HDAC1 (0.50) | ALDH1A1MEN1KMT2APKMHDAC1 | |
| SCHEMBL23923983 | 0.70 | L3MBTL1 (0.55) | MEN1KMT2APTGS2HDAC1HDAC7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1349552-A1 | PYRAZOLO 3,4-D]PYRIMIDINE DERIVATIVES AND THEIR USE AS PURINERGIC RECEPTOR ANTAGONISTS | VERNALIS RESEARCH LIMITED (GB) | 2003-10-08 | — | — | EP | disclosed |
| WO-2002055082-A1 | PYRAZOLO[3,4-D]PYRIMIDINE DERIVATIVES AND THEIR USE AS PURINERGIC RECEPTOR ANTAGONISTS | VERNALIS RESEARCH LIMITED (GB) | 2002-07-18 | — | — | WO | disclosed |