Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.67 |
| ▸ | MAPT | P10636 | 2/20 | 0.67 |
| ▸ | PKM | P14618 | 1/20 | 0.67 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | SCD | O00767 | 2/20 | 0.46 |
| ▸ | SCD5 | Q86SK9 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28801119 | 0.83 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1MAPTPKMRAB9A | |
| SCHEMBL3091005 | 0.81 | ALDH1A1 (0.63) | ALDH1A1L3MBTL1MAPTPKMRAB9A | |
| SCHEMBL15520765 | 0.80 | ALDH1A1 (1.00) | ALDH1A1L3MBTL1MAPTPKMRAB9A | |
| SCHEMBL16095711 | 0.80 | ALDH1A1 (0.67) | ALDH1A1L3MBTL1MAPTPKMKMT2A | |
| SCHEMBL15544649 | 0.80 | ALDH1A1 (0.67) | ALDH1A1L3MBTL1MAPTPKMRAB9A | |
| SCHEMBL3085251 | 0.78 | ALDH1A1 (0.63) | ALDH1A1L3MBTL1MAPTPKMRAB9A | |
| SCHEMBL15014102 | 0.78 | L3MBTL1 (0.63) | ALDH1A1L3MBTL1MAPTPKMSMN1; SMN2 | |
| SCHEMBL6264956 | 0.77 | L3MBTL1 (0.65) | ALDH1A1L3MBTL1MAPTPKMRAB9A | |
| SCHEMBL4765713 | 0.76 | ALDH1A1 (0.61) | ALDH1A1L3MBTL1MAPTPKMSMN1; SMN2 | |
| SCHEMBL27787140 | 0.76 | ALDH1A1 (0.61) | ALDH1A1L3MBTL1MAPTPKMRAB9A |
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 |