Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | FBP1 | P09467 | 1/20 | 0.30 |
| ▸ | MITF | O75030 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25607648 | 1.00 | BRAF (0.32) | BRAFPKMALDH1A1MAPTRAB9A | |
| SCHEMBL28994106 | 0.85 | MAPT (0.33) | BRAFALDH1A1MAPTRAB9AMAPK1 | |
| SCHEMBL25607643 | 0.85 | MAPT (0.33) | BRAFALDH1A1MAPTRAB9AMAPK1 | |
| SCHEMBL24618613 | 0.83 | XDH (0.32) | — | |
| SCHEMBL28994121 | 0.78 | MAPT (0.36) | BRAFALDH1A1MAPTRAB9AMAPK1 | |
| SCHEMBL25607652 | 0.78 | MAPT (0.36) | BRAFALDH1A1MAPTRAB9AMAPK1 | |
| SCHEMBL25607598 | 0.74 | MAPT (0.37) | PKMALDH1A1MAPTRAB9AMAPK1 | |
| SCHEMBL28994477 | 0.74 | FBP1 (0.35) | ALDH1A1MAPTRECQLKMT2AL3MBTL1 | |
| SCHEMBL24618692 | 0.67 | SLC6A2 (0.36) | — | |
| SCHEMBL28994095 | 0.66 | ALDH1A1 (0.34) | BRAFPKMALDH1A1MAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-115867553-A | Diaminopyrazolo [1,5-a ] pyrimidine-6-carbonitrile compounds as adenosine 2A receptor and adenosine 2B receptor antagonists | 巴格沃克斯研究有限公司 | 2023-03-28 | — | — | CN | disclosed |