Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 2/20 | 0.36 |
| ▸ | HTR1B | P28222 | 2/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 8/20 | 0.35 |
| ▸ | DRD3 | P35462 | 7/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.32 |
| ▸ | HTR7 | P34969 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
| ▸ | HCAR2 | Q8TDS4 | 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 | |
|---|---|---|---|---|
| SCHEMBL5684977 | 0.90 | HTR1D (0.35) | HTR1DHTR1BFYNCYP3A4CYP2C8 | |
| SCHEMBL5685005 | 0.88 | CYP3A4 (0.39) | HTR1DHTR1BFYNCYP3A4CYP2C8 | |
| SCHEMBL5684853 | 0.88 | FYN (0.36) | HTR1DHTR1BFYNCYP3A4CYP2C8 | |
| SCHEMBL5684743 | 0.88 | HTR1D (0.36) | HTR1DHTR1BFYNCYP3A4CYP2C8 | |
| SCHEMBL5687363 | 0.85 | CYP2D6 (0.38) | HTR1DHTR1BFYNCYP3A4CYP2C8 | |
| SCHEMBL5684294 | 0.85 | DRD3 (0.36) | HTR1DHTR1BFYNCYP3A4CYP2C8 | |
| SCHEMBL5684585 | 0.84 | MAOB (0.40) | HTR1DHTR1BCYP3A4CYP2C8CYP2D6 | |
| SCHEMBL5684416 | 0.83 | CYP3A4 (0.39) | HTR1DHTR1BCYP3A4CYP2C8CYP2D6 | |
| SCHEMBL5684871 | 0.83 | HTR1D (0.36) | HTR1DHTR1BFYNCYP3A4CYP2C8 | |
| SCHEMBL6157618 | 0.81 | HTR1D (0.36) | HTR1DHTR1BFYNCYP3A4CYP2C8 |
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 |
|---|---|---|---|---|---|---|---|
| US-7067179-B1 | Fused ring compound | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2006-06-27 | — | — | US | disclosed |
| EP-1201632-B1 | FUSED RING COMPOUND | DAINIPPON INK & CHEMICALS (JP) | 2006-03-29 | — | — | EP | disclosed |
| EP-1201632-A1 | FUSED RING COMPOUND | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2002-05-02 | — | — | EP | disclosed |