Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.59 |
| ▸ | TUBB1 | Q9H4B7 | 4/20 | 0.51 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.51 |
| ▸ | TUBB | P07437 | 2/20 | 0.51 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.51 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.51 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.51 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.51 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.51 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.51 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.51 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.51 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.51 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.51 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.51 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.51 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL29033616 | 1.00 | BRD4 (0.59) | BRD4TUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL29033608 | 0.89 | BRD4 (0.54) | BRD4TUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL29033615 | 0.81 | BRD4 (0.59) | BRD4TUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL25921904 | 0.81 | KDM4E (0.46) | BRD4ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL31317521 | 0.74 | BRD4 (1.00) | BRD4PDE10AALDH1A1GAANPC1 | |
| SCHEMBL4980044 | 0.73 | PDE5A (0.45) | ALDH1A1TNKSTNKS2HTTMEN1 | |
| SCHEMBL1337691 | 0.72 | TUBB1 (0.55) | TUBB1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL4981854 | 0.72 | PDE5A (0.51) | ALDH1A1TNKSPARP1TNKS2KMT2A | |
| SCHEMBL4986822 | 0.71 | KMT2A (0.50) | TUBB1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL31317586 | 0.71 | BRD4 (0.75) | BRD4TUBB1TUBB4ATUBBTUBA3C |
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 |