Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NSD2 | O96028 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11476180 | 0.85 | SIRT1 (0.67) | SIRT1ALDH1A1L3MBTL1ALOX15LMNA | |
| SCHEMBL8531499 | 0.84 | SIRT1 (0.56) | SIRT1SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL3440670 | 0.81 | HTT (0.51) | ALDH1A1L3MBTL1ALOX15LMNAMAPT | |
| SCHEMBL9815789 | 0.81 | ALDH1A1 (0.52) | SIRT1SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8529733 | 0.80 | MEN1 (0.54) | SIRT1SLC6A2SLC6A4SLC6A3CHRM2 | |
| SCHEMBL28304795 | 0.80 | SIRT1 (0.51) | SIRT1SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8610734 | 0.79 | HPGD (0.44) | CHRM2CHRM1CHRM3ALDH1A1L3MBTL1 | |
| SCHEMBL21679514 | 0.79 | SIRT1 (0.54) | SIRT1SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8529802 | 0.79 | SLC6A2 (0.48) | SIRT1SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL13240454 | 0.78 | LMNA (0.62) | SIRT1ALDH1A1LMNAMAPTRAB9A |
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 |