Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ITGAL | P20701 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | SLC6A9 | P48067 | 5/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6216437 | 0.86 | NSD2 (0.44) | HPGDALDH1A1ARITGALGRM4 | |
| SCHEMBL8533973 | 0.85 | ALDH1A1 (0.60) | HPGDALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL5833804 | 0.78 | KMT2A (0.50) | HPGDALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL11749787 | 0.75 | SIRT1 (0.61) | HPGDALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL8534092 | 0.74 | ALDH1A1 (0.69) | HPGDALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL8530163 | 0.74 | ALDH1A1 (0.54) | HPGDALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL8529733 | 0.74 | MEN1 (0.54) | HPGDALDH1A1MEN1MAPTKMT2A | |
| Hydrochloric Acid SCHEMBL8586417 | 0.73 | SLC6A4 (0.57) | ALDH1A1SLC6A4 | |
| SCHEMBL232284 | 0.73 | HTT (0.50) | HPGDALDH1A1MEN1KMT2AAR | |
| SCHEMBL8533938 | 0.73 | ALDH1A1 (0.53) | HPGDALDH1A1MEN1MAPTKMT2A |
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-0859757-A1 | DERIVATES OF N,N-DIMETHYL-2-(ARYLTHIO)BENZYLAMINE, THEIR SALTS, METHODS OF PREPARATION AND THEIR USE IN PHARMACEUTICAL MEDICAMENTS | Farmak A.S. (CZ) | 1998-08-26 | — | — | EP | disclosed |
| WO-1997017325-A1 | DERIVATES OF N,N-DIMETHYL-2-(ARYLTHIO)BENZYLAMINE, THEIR SALTS, METHODS OF PREPARATION AND THEIR USE IN PHARMACEUTICAL MEDICAMENTS | FARMAK A.S. (CZ) | 1997-05-15 | — | — | WO | disclosed |