Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | PGK1 | P00558 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL27993161 | 0.88 | PGK1 (0.45) | CYP1A2CYP2C19CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27993499 | 0.85 | CYP1A2 (0.49) | CYP1A2CYP2C19CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL28816026 | 0.80 | CYP1A2 (0.56) | CYP1A2CYP2C19CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27993157 | 0.79 | MEN1 (0.52) | CYP1A2CYP2C19CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL11651996 | 0.76 | PGK1 (0.50) | PGK1MAPT | |
| SCHEMBL27993563 | 0.74 | CYP3A4 (0.46) | CYP1A2CYP2C19CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27993397 | 0.74 | PGK1 (0.45) | CYP1A2CYP2C19CYP2C9MEN1KMT2A | |
| SCHEMBL27986798 | 0.74 | MEN1 (0.42) | CYP2C19NPC1RAB9AMEN1KMT2A | |
| SCHEMBL1978817 | 0.72 | MAPT (0.67) | PGK1MAPTPOLB | |
| SCHEMBL30154422 | 0.72 | MAPT (0.67) | PGK1MAPTPOLB |
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-104163791-A | N-pyridine (hetero) aryl amide compound and preparation method and application thereof | HUNAN RES INST CHEMICAL IND | 2014-11-26 | — | — | CN | claimed |
| CN-104163791-A | N-pyridine (hetero) aryl amide compound and preparation method and application thereof | HUNAN RES INST CHEMICAL IND | 2014-11-26 | — | — | CN | disclosed |