Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8972473 | 0.75 | MAOA (0.39) | MAOAMAOBADRA1DADRA1AADRA1B | |
| SCHEMBL29900352 | 0.70 | GABRA1 (0.61) | GABRA1GABRB2ADRA1DADRA1AADRA1B | |
| SCHEMBL2362466 | 0.70 | GABRA1 (0.61) | GABRA1GABRB2ADRA1DADRA1AADRA1B | |
| SCHEMBL29438383 | 0.68 | MAOA (0.45) | MAOAMAOBKDM4EALDH1A1MAPT | |
| SCHEMBL667761 | 0.68 | MAOA (0.45) | MAOAMAOBKDM4EALDH1A1MAPT | |
| SCHEMBL8964203 | 0.67 | MAOA (0.37) | MAOAMAOBKDM4EALDH1A1MAPK1 | |
| SCHEMBL6705766 | 0.66 | HTR6 (0.49) | GABRA1GABRB2ADRA1DADRA1AADRA1B | |
| SCHEMBL5451295 | 0.66 | GABRA1 (0.52) | GABRA1GABRB2ADRA1DADRA1AADRA1B | |
| SCHEMBL7060258 | 0.65 | MAOA (0.38) | MAOAMAOBGAA | |
| SCHEMBL11664999 | 0.65 | NOTUM (0.38) | MAOAMAOBKDM4EALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4049653-A | ANALGESICS, ANTIANXIETY AGENTS | ABBOTT LABORATORIES (US) | 1977-09-20 | — | — | US | disclosed |