Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2E1 | P05181 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | BRD4 | O60885 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | DHPS | P49366 | 2/20 | 0.50 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
| ▸ | TEK | Q02763 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.47 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29114961 | 1.00 | CYP2E1 (0.57) | CYP2E1CYP3A4CYP2D6CYP2A6CYP2C9 | |
| SCHEMBL28027825 | 0.86 | BRD4 (0.64) | BRD4ALDH1A1SMN1; SMN2KDM4EGABRA1 | |
| SCHEMBL28716789 | 0.79 | BRD4 (0.61) | CYP3A4CYP2C9CYP2C19BRD4L3MBTL1 | |
| SCHEMBL28714937 | 0.79 | BRD4 (0.57) | BRD4ALDH1A1SMN1; SMN2GABRA1GABRB2 | |
| SCHEMBL28704101 | 0.79 | BRD4 (0.57) | BRD4ALDH1A1SMN1; SMN2GABRA1GABRB2 | |
| SCHEMBL27914817 | 0.79 | BRD4 (0.61) | CYP3A4CYP2C9CYP2C19BRD4L3MBTL1 | |
| SCHEMBL29502227 | 0.78 | BRD4 (0.55) | BRD4ALDH1A1SMN1; SMN2GABRA1GABRB2 | |
| SCHEMBL29114962 | 0.77 | BRD4 (0.57) | CYP3A4CYP2C9CYP2C19BRD4L3MBTL1 | |
| SCHEMBL17139981 | 0.76 | CYP2E1 (0.42) | CYP2E1CYP3A4CYP2D6CYP2A6CYP2C9 | |
| SCHEMBL27914895 | 0.76 | BRD4 (0.54) | BRD4L3MBTL1ALDH1A1SMN1; SMN2KDM4E |
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-114853676-B | Synthesis method of 1H-imidazole compound | 湖南第一师范学院 | 2023-11-17 | — | — | CN | disclosed |
| CN-114853676-A | Synthesis method of 1H-imidazole compound | 湖南第一师范学院 | 2022-08-05 | — | — | CN | disclosed |