Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 7/20 | 0.37 |
| ▸ | TAS2R8 | Q9NYW2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.32 |
| ▸ | KLK1 | P06870 | 1/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GRN | P28799 | 1/20 | 0.32 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22216432 | 0.86 | KDM4E (0.38) | ACHETAS2R8LMNAMAPTCYP2C19 | |
| SCHEMBL22216435 | 0.85 | L3MBTL1 (0.39) | ACHELMNAMAPTCYP2C19GFER | |
| SCHEMBL22216335 | 0.82 | KLKB1 (0.37) | ACHELMNAMAPTCYP2C19GFER | |
| SCHEMBL22207003 | 0.79 | L3MBTL1 (0.36) | ACHELMNAMAPTCYP2C19GFER | |
| SCHEMBL22207006 | 0.79 | L3MBTL1 (0.36) | ACHELMNAMAPTCYP2C19GFER | |
| SCHEMBL28432378 | 0.77 | KLKB1 (0.34) | ACHELMNAMAPTCYP2C19GFER | |
| SCHEMBL28432376 | 0.77 | KLKB1 (0.34) | ACHELMNAMAPTCYP2C19GFER | |
| SCHEMBL22216455 | 0.74 | LMNA (0.42) | ACHELMNAMAPTCYP2C19GFER | |
| SCHEMBL23907239 | 0.73 | AOC3 (0.36) | ACHELMNAMAPTCYP2C19GFER | |
| SCHEMBL28433237 | 0.73 | SCD (0.34) | ACHELMNAMAPTCYP2C19GFER |
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 |
|---|---|---|---|---|---|---|---|
| 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 |