Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 7/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KLK1 | P06870 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | CSF1R | P07333 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22216339 | 0.90 | KLKB1 (0.41) | LMNAHPGDL3MBTL1MAPTCYP2C19 | |
| SCHEMBL22216435 | 0.88 | L3MBTL1 (0.39) | LMNAHPGDL3MBTL1MAPTCYP2C19 | |
| SCHEMBL23907287 | 0.88 | LMNA (0.39) | LMNAHPGDL3MBTL1MAPTCYP2C19 | |
| SCHEMBL23907289 | 0.88 | LMNA (0.39) | LMNAHPGDL3MBTL1MAPTCYP2C19 | |
| SCHEMBL22216190 | 0.86 | AOC3 (0.42) | LMNAHPGDL3MBTL1MAPTCYP2C19 | |
| SCHEMBL28426245 | 0.85 | LMNA (0.37) | LMNAHPGDL3MBTL1MAPTCYP2C19 | |
| SCHEMBL28426244 | 0.85 | LMNA (0.37) | LMNAHPGDL3MBTL1MAPTCYP2C19 | |
| SCHEMBL22216433 | 0.83 | L3MBTL1 (0.56) | LMNAL3MBTL1MAPTCYP2C19GFER | |
| SCHEMBL23920716 | 0.83 | HPGD (0.40) | LMNAHPGDL3MBTL1MAPTCYP2C19 | |
| SCHEMBL22207024 | 0.82 | LMNA (0.35) | LMNAHPGDL3MBTL1MAPTCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3892621-A1 | HALOALLYLAMINE COMPOUNDS AND APPLICATION THEREOF | Nanjing Transthera Biosciences Co., Ltd. (CN) | 2021-10-13 | — | — | EP | disclosed |
| WO-2020143763-A1 | HALOALLYLAMINE COMPOUNDS AND APPLICATION THEREOF | 南京药捷安康生物科技有限公司 | 2020-07-16 | — | — | WO | disclosed |