Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23907225 | 1.00 | MAPT (0.43) | MAPTLMNACYP2C19GFERNPSR1 | |
| SCHEMBL22216188 | 0.86 | LMNA (0.46) | MAPTLMNACYP2C19GFERNPSR1 | |
| SCHEMBL22216318 | 0.86 | LMNA (0.51) | MAPTLMNACYP2C19GFERNPSR1 | |
| SCHEMBL23907278 | 0.86 | LMNA (0.46) | MAPTLMNACYP2C19GFERNPSR1 | |
| SCHEMBL22207031 | 0.86 | MAPT (0.42) | MAPTLMNACYP2C19GFERNPSR1 | |
| SCHEMBL22207033 | 0.86 | MAPT (0.42) | MAPTLMNACYP2C19GFERNPSR1 | |
| SCHEMBL22207003 | 0.81 | L3MBTL1 (0.36) | MAPTLMNACYP2C19GFERNPSR1 | |
| SCHEMBL22207006 | 0.81 | L3MBTL1 (0.36) | MAPTLMNACYP2C19GFERNPSR1 | |
| SCHEMBL23907289 | 0.80 | LMNA (0.39) | MAPTLMNACYP2C19GFERNPSR1 | |
| SCHEMBL23907287 | 0.80 | LMNA (0.39) | MAPTLMNACYP2C19GFERNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3892621-A1 | HALOALLYLAMINE COMPOUNDS AND APPLICATION THEREOF | Nanjing Transthera Biosciences Co., Ltd. (CN) | 2021-10-13 | — | — | EP | disclosed |