Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.63 |
| ▸ | MAOB | P27338 | 4/20 | 0.63 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.52 |
| ▸ | HTR1A | P08908 | 2/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.52 |
| ▸ | DRD3 | P35462 | 2/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | DRD1 | P21728 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | HRH1 | P35367 | 5/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL16373180 | 0.84 | AKR1B10 (0.44) | MAOAMAOBHDAC1HDAC6ADRA2A | |
| SCHEMBL3715242 | 0.76 | MAOA (0.75) | MAOAMAOBHDAC1HDAC6ADRA2A | |
| SCHEMBL18477556 | 0.76 | MAOA (0.71) | MAOAMAOBHDAC1HDAC6ADRA2A | |
| SCHEMBL3721557 | 0.75 | MAOA (0.73) | MAOAMAOBHDAC1HDAC6ADRA2A | |
| SCHEMBL16335746 | 0.74 | GRIN2B (0.46) | HRH1HTR6BCHE | |
| SCHEMBL16373178 | 0.73 | AKR1B10 (0.49) | HDAC1HDAC6ADRA2AADRA1AHRH1 | |
| SCHEMBL16373177 | 0.73 | ABCB1 (0.41) | ADRA2AADRA1ACHRM2HTR1ASLC6A2 | |
| SCHEMBL18494979 | 0.72 | MAOA (0.76) | MAOAMAOBHDAC1HDAC6ADRA2A | |
| SCHEMBL16373176 | 0.72 | AKR1B10 (0.47) | HRH1HTR6 | |
| SCHEMBL16373179 | 0.71 | AKR1B10 (0.61) | MAOAMAOBHDAC1HDAC6HRH1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014207241-A1 | NEW Na-SUBSTITUTED CARBOLINE COMPOUNDS USABLE FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES | ALZPROTECT (FR) | 2014-12-31 | — | — | WO | disclosed |