Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 5/20 | 0.32 |
| ▸ | HTR2C | P28335 | 5/20 | 0.32 |
| ▸ | HRH1 | P35367 | 3/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14135291 | 0.74 | MAOA (0.42) | CYP2C9MAOAMAOBATMHTR2A | |
| SCHEMBL30883178 | 0.74 | MAOA (0.42) | CYP2C9MAOAMAOBATMHTR2A | |
| SCHEMBL2228109 | 0.72 | ESR1 (0.34) | — | |
| SCHEMBL16257251 | 0.71 | STS (0.50) | CYP2C9MAOAMAOBATMHTR2A | |
| SCHEMBL16198062 | 0.70 | DRD2 (0.44) | DRD2DRD3HTR2B | |
| SCHEMBL20785351 | 0.68 | MAOA (0.46) | CYP2C9MAOAMAOBATMGRM1 | |
| SCHEMBL20785353 | 0.68 | MAOA (0.46) | CYP2C9MAOAMAOBATMGRM1 | |
| SCHEMBL20785352 | 0.68 | MAOA (0.46) | CYP2C9MAOAMAOBATMGRM1 | |
| SCHEMBL20785354 | 0.68 | MAOA (0.46) | CYP2C9MAOAMAOBATMGRM1 | |
| SCHEMBL16785724 | 0.68 | MAOA (0.46) | CYP2C9MAOAMAOBATMGRM1 |
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-2958924-B1 | 5H-CHROMENO[3,4-C]PYRIDINES AS INHIBITORS OF ADAPTOR ASSOCIATED KINASE 1 (AAK1) | BRISTOL MYERS SQUIBB CO (US) | 2016-12-28 | — | — | EP | disclosed |
| US-5760050-A | SCHIZOPHRENIA | WARNER-LAMBERT COMPANY (US) | 1998-06-02 | — | — | US | disclosed |