Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | BCHE | P06276 | 2/20 | 0.49 |
| ▸ | ACHE | P22303 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.45 |
| ▸ | L3MBTL4 | Q8NA19 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28007211 | 0.98 | CYP1A2 (0.51) | CYP1A2CYP2C9CYP2C19BCHEACHE | |
| SCHEMBL1342454 | 0.95 | CYP1A2 (0.59) | CYP1A2CYP2C9CYP2C19BCHEACHE | |
| SCHEMBL1341908 | 0.89 | ALDH1A1 (0.53) | CYP1A2CYP2C9CYP2C19BCHEACHE | |
| SCHEMBL20214357 | 0.87 | TDP1 (0.50) | CYP1A2CYP2C9CYP2C19BCHEACHE | |
| SCHEMBL5854291 | 0.84 | ALDH1A1 (0.53) | CYP1A2CYP2C9CYP2C19MAPTALDH1A1 | |
| SCHEMBL12432103 | 0.84 | ALDH1A1 (0.53) | CYP1A2CYP2C9CYP2C19MAPTALDH1A1 | |
| SCHEMBL20463144 | 0.84 | L3MBTL4 (0.46) | CYP1A2CYP2C9CYP2C19BCHEACHE | |
| SCHEMBL9621578 | 0.84 | ALDH1A1 (0.67) | CYP1A2CYP2C9CYP2C19BCHEACHE | |
| SCHEMBL11956144 | 0.83 | MAPT (0.56) | CYP1A2CYP2C9CYP2C19MAPTALDH1A1 | |
| SCHEMBL351594 | 0.82 | TSHR (0.56) | CYP1A2CYP2C9CYP2C19BCHEACHE |
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-105085576-A | Pyridinamine-based chromium complex and preparation method and application thereof | UNIV EAST CHINA SCIENCE & TECH | 2015-11-25 | — | — | CN | disclosed |