Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.56 |
| ▸ | DRD3 | P35462 | 3/20 | 0.56 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.54 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.54 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 3/20 | 0.49 |
| ▸ | DRD1 | P21728 | 1/20 | 0.49 |
| ▸ | DRD4 | P21917 | 1/20 | 0.49 |
| ▸ | DRD5 | P21918 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL708228 | 0.83 | ADRA2A (0.67) | DRD2DRD3ADRA2AADRA2BADRA2C | |
| SCHEMBL12653320 | 0.80 | ALDH1A1 (0.67) | ALDH1A1 | |
| SCHEMBL11545434 | 0.79 | HTR2A (0.67) | DRD2DRD3ADRA2AADRA2BADRA2C | |
| SCHEMBL9027195 | 0.78 | SIGMAR1 (0.54) | ADRA1DADRA1AADRA1BHTR1AALDH1A1 | |
| SCHEMBL5335494 | 0.77 | HTR2A (0.68) | DRD2DRD3ADRA2AADRA2BADRA2C | |
| SCHEMBL9671554 | 0.76 | HTR2A (0.54) | DRD2DRD3ADRA2AADRA2BADRA2C | |
| SCHEMBL11545316 | 0.76 | DRD2 (0.63) | DRD2DRD3ADRA2AADRA2BADRA2C | |
| SCHEMBL11546493 | 0.76 | DRD2 (0.63) | DRD2DRD3ADRA2AADRA2BADRA2C | |
| SCHEMBL5339006 | 0.75 | DRD2 (0.75) | DRD2DRD3ADRA2AADRA2BADRA2C | |
| SCHEMBL5336211 | 0.74 | HTR2A (0.64) | DRD2DRD3ADRA2AADRA2BADRA2C |
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-0700385-A1 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM LABORATOIRES PHARMACEUTIQUES (FR) | 1996-03-13 | — | — | EP | disclosed |
| WO-1994027967-A1 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM LABORATOIRES PHARMACEUTIQUES (FR) | 1994-12-08 | — | — | WO | disclosed |