Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.46 |
| ▸ | SLC22A1 | O15245 | 3/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.46 |
| ▸ | DRD3 | P35462 | 3/20 | 0.46 |
| ▸ | CACNA1B | Q00975 | 3/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | HRH1 | P35367 | 3/20 | 0.46 |
| ▸ | SLC22A2 | O15244 | 2/20 | 0.46 |
| ▸ | SLC22A3 | O75751 | 2/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9378395 | 0.88 | POLB (0.59) | MAOAMAOBCHRM2CHRM1ADRA1A | |
| SCHEMBL8143078 | 0.80 | HTR2A (0.50) | HTR2ASLC6A4SLC6A2SLC22A1CHRM2 | |
| SCHEMBL5661000 | 0.78 | HTR1A (0.50) | MAOAMAOBDRD3DRD2HTR1A | |
| SCHEMBL28963619 | 0.78 | MAOA (0.42) | HTR2AMAOAMAOBSLC6A4SLC6A2 | |
| SCHEMBL22870187 | 0.77 | SLC6A4 (0.47) | HTR2ASLC6A4SLC6A2SLC22A1CHRM2 | |
| SCHEMBL4817825 | 0.77 | ALDH1A1 (0.63) | LMNAMAPTALDH1A1POLBMEN1 | |
| Methane SCHEMBL29165350 | 0.77 | HTR1A (0.49) | MAOAMAOBDRD3DRD2HTR1A | |
| SCHEMBL4106226 | 0.74 | ALDH1A1 (0.57) | CHRM2CHRM1CHRM3MAPTALDH1A1 | |
| SCHEMBL9384361 | 0.74 | MAOA (0.46) | MAOAMAOBCYP2D6CYP3A4ALDH1A1 | |
| SCHEMBL8906341 | 0.73 | MAOA (0.39) | HTR2AMAOAMAOBPOLBCYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6569849-B1 | N-Substituted azaheterocyclic compounds | NOVO NORDISK A/S (DK) | 2003-05-27 | — | — | US | disclosed |
| EP-0934306-A1 | N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS | NOVO NORDISK A/S (DK) | 1999-08-11 | — | — | EP | disclosed |
| WO-1998015546-A1 | N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS | NOVO NORDISK A/S (DK) | 1998-04-16 | — | — | WO | disclosed |
| US-4065471-A | N-(4-Amino-2-butynyl)imides | STERLING DRUG INC. (US) | 1977-12-27 | — | — | US | disclosed |