Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | MGMT | P16455 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28306387 | 0.91 | NOS2 (0.42) | BACE1NOS2SMN1; SMN2MAPTLMNA | |
| SCHEMBL28306160 | 0.88 | HTT (0.39) | NOS3NOS2SMN1; SMN2MAPTLMNA | |
| SCHEMBL28306168 | 0.74 | CCNA2 (0.42) | NOS3NOS1NOS2SMN1; SMN2MAPT | |
| SCHEMBL28306171 | 0.73 | MAPT (0.38) | SMN1; SMN2MAPTLMNAHPGDL3MBTL1 | |
| SCHEMBL11798967 | 0.70 | ALDH1A1 (0.44) | BACE1NOS3NOS1NOS2CYP1A2 | |
| SCHEMBL28306384 | 0.70 | PKM (0.35) | NOS2SMN1; SMN2MAPTLMNAHPGD | |
| SCHEMBL10504960 | 0.68 | ALDH1A1 (0.42) | BACE1SMN1; SMN2CYP1A2MAPTLMNA | |
| SCHEMBL28307335 | 0.68 | HTT (0.38) | BACE1SMN1; SMN2MAPTLMNAHPGD | |
| SCHEMBL28946189 | 0.68 | HTT (0.35) | BACE1SMN1; SMN2MAPTLMNAHPGD | |
| SCHEMBL12484627 | 0.65 | BACE1 (0.36) | BACE1NOS3NOS1NOS2SMN1; SMN2 |
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-109970633-A | Pyridine sulfone and its derivative, preparation method and application | 湖南化工研究院有限公司 | 2019-07-05 | — | — | CN | claimed |
| CN-109970633-A | Pyridine sulfone and its derivative, preparation method and application | 湖南化工研究院有限公司 | 2019-07-05 | — | — | CN | disclosed |