Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | TOP2A | P11388 | 1/20 | 0.43 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL29033615 | 0.89 | BRD4 (0.59) | BRD4ALDH1A1GAATUBB4ATUBB | |
| SCHEMBL29033613 | 0.89 | TUBB1 (0.43) | BRD4ALDH1A1GAAALOX15HSD17B10 | |
| SCHEMBL29033612 | 0.87 | CYP1A2 (0.48) | BRD4SMN1; SMN2TSHRALDH1A1GAA | |
| SCHEMBL30498918 | 0.87 | CYP1A2 (0.48) | BRD4SMN1; SMN2TSHRALDH1A1GAA | |
| SCHEMBL30498919 | 0.87 | CYP1A2 (0.48) | BRD4SMN1; SMN2TSHRALDH1A1GAA | |
| SCHEMBL29033631 | 0.85 | BRD4 (0.43) | BRD4SMN1; SMN2TSHRHDAC3APP | |
| SCHEMBL29033620 | 0.85 | BRD4 (0.41) | BRD4KMT2ASMN1; SMN2HDAC3APP | |
| SCHEMBL30498908 | 0.85 | TUBB1 (0.53) | BRD4HDAC3APPACHEHDAC4 | |
| SCHEMBL29033619 | 0.85 | TUBB1 (0.53) | BRD4HDAC3APPACHEHDAC4 | |
| SCHEMBL29033621 | 0.84 | BRD4 (0.42) | BRD4KMT2ASMN1; SMN2MEN1POLB |
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-116444443-A | Benzoyl-quinazolinone derivative, and preparation method and application thereof | 广东省中医院（广州中医药大学第二附属医院、广州中医药大学第二临床医学院、广东省中医药科学院） | 2023-07-18 | — | — | CN | disclosed |