Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 4/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.47 |
| ▸ | PDE4A | P27815 | 1/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PDE1A | P54750 | 1/20 | 0.45 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8039681 | 0.91 | PDE5A (0.57) | PDE5AALDH1A1NPSR1MAPTSMN1; SMN2 | |
| SCHEMBL8041155 | 0.84 | PDE5A (0.66) | PDE5AALDH1A1NPSR1MAPTSMN1; SMN2 | |
| SCHEMBL6403580 | 0.83 | ALDH1A1 (0.53) | ALDH1A1NPSR1MAPTSMN1; SMN2CYP1A2 | |
| SCHEMBL7336519 | 0.77 | PDE5A (1.00) | PDE5AALDH1A1PDE4DPDE4APDE4B | |
| SCHEMBL7337371 | 0.75 | PDE5A (1.00) | PDE5AALDH1A1NPSR1MAPTPDE4D | |
| SCHEMBL6349071 | 0.75 | PDE5A (0.55) | PDE5AALDH1A1NPSR1MAPTSMN1; SMN2 | |
| SCHEMBL6349070 | 0.75 | PDE5A (0.55) | PDE5AALDH1A1NPSR1MAPTSMN1; SMN2 | |
| SCHEMBL19472685 | 0.74 | PDE5A (0.60) | PDE5AALDH1A1NPSR1MAPTCYP1A2 | |
| SCHEMBL28560359 | 0.74 | TSHR (0.62) | ALDH1A1MAPTSMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL8039707 | 0.74 | MEN1 (0.55) | PDE5ASMN1; SMN2NPC1RAB9AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0806412-B1 | BENZENE DERIVATIVES | TEIJIN LTD (JP) | 2000-04-05 | — | — | EP | disclosed |