Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 6/20 | 0.60 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.47 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.47 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.45 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 3/20 | 0.43 |
| ▸ | PLK4 | O00444 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.43 |
| ▸ | INSR | P06213 | 1/20 | 0.43 |
| ▸ | IGF1R | P08069 | 1/20 | 0.43 |
| ▸ | MET | P08581 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17731629 | 0.78 | MAP2K1 (0.47) | PDE3BPDE3AMEN1NPC1RAB9A | |
| SCHEMBL1303787 | 0.76 | ABCG2 (0.51) | PDE3BPDE3AGRIA1CACNG8MEN1 | |
| SCHEMBL20100921 | 0.70 | BRD4 (0.61) | BRD4ADORA3ADORA2APARP1 | |
| SCHEMBL13813534 | 0.70 | ADORA3 (0.52) | BRD4MEN1KMT2AADORA3ADORA2A | |
| SCHEMBL20100920 | 0.69 | BRD4 (0.56) | BRD4MEN1NPC1RAB9AKMT2A | |
| SCHEMBL30663468 | 0.69 | BRD4 (1.00) | BRD4ABL1BRAFFLT3 | |
| SCHEMBL29109165 | 0.69 | BRD4 (1.00) | BRD4ABL1BRAFFLT3 | |
| SCHEMBL30663518 | 0.69 | BRD4 (1.00) | BRD4AURKAABL1KDRFLT3 | |
| SCHEMBL29109173 | 0.69 | BRD4 (1.00) | BRD4AURKAABL1KDRFLT3 | |
| SCHEMBL10653538 | 0.68 | CCNB2 (0.48) | BRD4PDE3BPDE3AMEN1KMT2A |
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-117050075-A | Biaryl ring BET inhibitor and synthetic method and application thereof | 中国药科大学 | 2023-11-14 | — | — | CN | disclosed |