Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 4/20 | 0.62 |
| ▸ | NPC1 | O15118 | 4/20 | 0.60 |
| ▸ | RAB9A | P51151 | 4/20 | 0.60 |
| ▸ | HTT | P42858 | 4/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | CDC7 | O00311 | 1/20 | 0.54 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.54 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | LCK | P06239 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.50 |
| ▸ | CASP7 | P55210 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL4913787 | 0.87 | RAB9A (0.72) | BRD4NPC1RAB9AHTTSMN1; SMN2 | |
| SCHEMBL29141645 | 0.86 | SMN1; SMN2 (0.63) | BRD4NPC1RAB9AHTTSMN1; SMN2 | |
| SCHEMBL29141658 | 0.82 | NPC1 (0.56) | BRD4NPC1RAB9AHTTSMN1; SMN2 | |
| SCHEMBL29501954 | 0.81 | LMNA (0.60) | BRD4NPC1RAB9AHTTSMN1; SMN2 | |
| SCHEMBL29141669 | 0.80 | SMN1; SMN2 (0.63) | BRD4NPC1RAB9AHTTSMN1; SMN2 | |
| SCHEMBL723441 | 0.78 | PRMT1 (0.74) | BRD4NPC1RAB9AHTTSMN1; SMN2 | |
| SCHEMBL29141659 | 0.78 | LCK (0.58) | BRD4NPC1RAB9AHTTSMN1; SMN2 | |
| SCHEMBL20119902 | 0.76 | HTT (0.73) | BRD4NPC1RAB9AHTTSMN1; SMN2 | |
| SCHEMBL9230081 | 0.76 | BRD4 (1.00) | BRD4NPC1RAB9AMAPTMKNK1 | |
| SCHEMBL29141655 | 0.76 | NPC1 (0.74) | BRD4NPC1RAB9AHTTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117430609-B | Purine derivative compound, preparation method and application thereof | 东北农业大学 | 2024-05-24 | — | — | CN | disclosed |
| CN-117430609-A | Purine derivative compound, preparation method and application thereof | 东北农业大学 | 2024-01-23 | — | — | CN | disclosed |