Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | BRD4 | O60885 | 12/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MET | P08581 | 1/20 | 0.47 |
| ▸ | AXL | P30530 | 1/20 | 0.47 |
| ▸ | BRD2 | P25440 | 1/20 | 0.47 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.47 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.47 |
| ▸ | SIRT6 | Q8N6T7 | 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 | |
|---|---|---|---|---|
| SCHEMBL28830959 | 1.00 | MAPT (0.53) | MAPTTP53THRBBRD4PKM | |
| SCHEMBL29845684 | 0.94 | MAPT (0.54) | MAPTTP53THRBBRD4PKM | |
| SCHEMBL28830970 | 0.94 | MAPT (0.54) | MAPTTP53THRBBRD4PKM | |
| SCHEMBL28830944 | 0.89 | BRD4 (0.57) | BRD4BRD2BRD3BRDT | |
| SCHEMBL29845977 | 0.89 | BRD4 (0.57) | BRD4BRD2BRD3BRDT | |
| SCHEMBL29845749 | 0.86 | BRD4 (0.55) | MAPTTP53THRBBRD4BRD2 | |
| SCHEMBL28830927 | 0.86 | BRD4 (0.55) | MAPTTP53THRBBRD4BRD2 | |
| SCHEMBL7537864 | 0.82 | MAPT (0.74) | MAPTTP53THRBPKMSMN1; SMN2 | |
| SCHEMBL28831087 | 0.80 | BRD4 (0.46) | BRD4BRD2BRD3BRDT | |
| SCHEMBL28480365 | 0.79 | BRD4 (0.53) | BRD4METAXLBRD2BRD3 |
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-115028646-B | Nitrogen-containing heterocyclic compound, preparation method and application thereof in antitumor preparation | 山东第一医科大学(山东省医学科学院) | 2023-06-30 | — | — | CN | disclosed |
| CN-115028646-A | Nitrogen-containing heterocyclic compound, preparation method and application in antitumor preparation | 山东第一医科大学(山东省医学科学院) | 2022-09-09 | — | — | CN | disclosed |