Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR6 | P51684 | 1/20 | 0.52 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4194136 | 0.83 | CCR6 (0.51) | CCR6PAX8ALDH1A1TDP1MAPK1 | |
| SCHEMBL1897393 | 0.83 | CCR6 (0.51) | CCR6PAX8ALDH1A1TDP1MAPK1 | |
| SCHEMBL16585962 | 0.81 | CCR6 (0.60) | CCR6PAX8ALDH1A1TDP1MAPK1 | |
| SCHEMBL19832018 | 0.80 | ALOX5 (0.54) | CCR6PAX8ALDH1A1TDP1MAPK1 | |
| SCHEMBL18057683 | 0.79 | CCR6 (0.61) | CCR6PAX8ALDH1A1TDP1MAPK1 | |
| SCHEMBL17747886 | 0.79 | CCR6 (0.48) | CCR6PAX8ALDH1A1TDP1MAPK1 | |
| SCHEMBL17377997 | 0.79 | CCR6 (0.61) | CCR6PAX8ALDH1A1TDP1MAPK1 | |
| SCHEMBL19346032 | 0.78 | CCR6 (0.53) | CCR6PAX8ALDH1A1TDP1MAPK1 | |
| SCHEMBL554069 | 0.78 | CCR6 (0.64) | CCR6PAX8ALDH1A1TDP1MAPK1 | |
| SCHEMBL28575124 | 0.78 | ALDH1A1 (0.52) | CCR6PAX8ALDH1A1TDP1MAPK1 |
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-1071654-A1 | A PROCESS FOR PREPARING CHIRAL (S)-2,3-DISUBSTITUTED-1-PROPYLAMINE DERIVATIVES | Samsung Fine Chemicals Co., Ltd. (KR) | 2001-01-31 | — | — | EP | disclosed |
| WO-1999052855-A1 | A PROCESS FOR PREPARING CHIRAL (S)-2,3-DISUBSTITUTED-1-PROPYLAMINE DERIVATIVES | SAMSUNG FINE CHEMICALS CO., LTD. (KR) | 1999-10-21 | — | — | WO | disclosed |