Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.43 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16719806 | 0.79 | ADRB1 (0.54) | GAAADRB1HTR6PIK3CDALDH1A1 | |
| SCHEMBL9464864 | 0.79 | MEN1 (0.54) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL27827559 | 0.73 | MEN1 (0.51) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL508849 | 0.73 | IDO1 (0.58) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL30557150 | 0.73 | ADRB1 (0.51) | GAAADRB1HTR6PIK3CDMAPT | |
| SCHEMBL31408101 | 0.72 | IDO1 (0.73) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL16382293 | 0.72 | IDO1 (0.73) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL3980479 | 0.72 | IDO1 (0.49) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11926855 | 0.71 | CYP3A4 (0.53) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL28957349 | 0.71 | IDO1 (0.56) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116253721-B | N- (4-indolyl) -N' -alkyl imidazole salt and application thereof | 昆明理工大学 | 2024-05-14 | — | — | CN | disclosed |
| CN-116253721-A | N- (4-indolyl) -N' -alkyl imidazole salt and application thereof | 昆明理工大学 | 2023-06-13 | — | — | CN | disclosed |
| CN-112876516-B | N- (4-indolyl) N-heterocyclic carbene palladium complex and application thereof | 昆明理工大学 | 2022-02-15 | — | — | CN | disclosed |
| CN-112876516-A | N- (4-indolyl) N-heterocyclic carbene palladium complex and application thereof | 昆明理工大学 | 2021-06-01 | — | — | CN | disclosed |