Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 4/20 | 0.38 |
| ▸ | DRD5 | P21918 | 4/20 | 0.38 |
| ▸ | DRD2 | P14416 | 3/20 | 0.38 |
| ▸ | DRD3 | P35462 | 3/20 | 0.38 |
| ▸ | MAOA | P21397 | 5/20 | 0.38 |
| ▸ | MAOB | P27338 | 5/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | BCL2 | P10415 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 2/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10376481 | 0.85 | ALOX15 (0.48) | ALOX15DRD3MAOA | |
| SCHEMBL10378519 | 0.74 | MAOA (0.44) | ALOX15DRD3MAOAMAOB | |
| SCHEMBL10378104 | 0.69 | MAOA (0.38) | ALOX15DRD3MAOA | |
| SCHEMBL15676305 | 0.67 | MAOA (0.67) | MAOAMAOBESR2ESR1TYR | |
| SCHEMBL10378389 | 0.67 | ALDH1A1 (0.38) | ALOX15MAOA | |
| SCHEMBL10950099 | 0.65 | CSNK2B (0.43) | — | |
| SCHEMBL7044120 | 0.65 | DRD2 (0.53) | DRD1DRD5DRD2DRD3MAOA | |
| SCHEMBL3741412 | 0.64 | MAOA (0.67) | MAOAMAOBESR2ESR1TYR | |
| SCHEMBL217399 | 0.63 | KDM4E (0.59) | DRD1DRD5DRD2DRD3MAOA | |
| SCHEMBL29373696 | 0.63 | KDM4E (0.59) | DRD1DRD5DRD2DRD3MAOA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0161102-B1 | ISOQUINOLINE DERIVATIVES | GLAXO GROUP LIMITED (GB) | 1990-02-21 | — | — | EP | disclosed |
| US-4835158-A | Isoquinoline derivatives | GLAXO GROUP LIMITED (GB) | 1989-05-30 | — | — | US | disclosed |
| EP-0161102-A2 | Isoquinoline derivatives | GLAXO GROUP LIMITED (GB) | 1985-11-13 | — | — | EP | disclosed |