Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | SLC10A2 | Q12908 | 1/20 | 0.39 |
| ▸ | TUBB1 | Q9H4B7 | 6/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.38 |
| ▸ | TUBB | P07437 | 3/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 3/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 3/20 | 0.38 |
| ▸ | TUBB2A | Q13885 | 3/20 | 0.38 |
| ▸ | TUBB8 | Q3ZCM7 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29033617 | 1.00 | MAPK1 (0.44) | MAPK1LMNAHTTRAB9ABRD4 | |
| SCHEMBL29033612 | 0.90 | CYP1A2 (0.48) | RAB9ABRD4SLC10A2TUBB1TUBB4A | |
| SCHEMBL30498918 | 0.90 | CYP1A2 (0.48) | RAB9ABRD4SLC10A2TUBB1TUBB4A | |
| SCHEMBL30498919 | 0.90 | CYP1A2 (0.48) | RAB9ABRD4SLC10A2TUBB1TUBB4A | |
| SCHEMBL30498908 | 0.88 | TUBB1 (0.53) | BRD4ACHETUBB1TUBB4ATUBB | |
| SCHEMBL29033619 | 0.88 | TUBB1 (0.53) | BRD4ACHETUBB1TUBB4ATUBB | |
| SCHEMBL29033631 | 0.88 | BRD4 (0.43) | HTTBRD4MMP13ACHESLC10A2 | |
| SCHEMBL30498922 | 0.87 | BRD4 (0.42) | HTTBRD4MMP13ACHESLC10A2 | |
| SCHEMBL29033605 | 0.87 | ALDH1A1 (0.51) | HTTBRD4ACHETUBB1TUBB4A | |
| SCHEMBL29033621 | 0.87 | BRD4 (0.42) | HTTBRD4MMP13ACHESLC10A2 |
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 |