Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD5 | P21918 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 2/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7918563 | 0.92 | HTR1A (0.42) | HTR1AALDH1A1CYP3A4CYP2D6TSHR | |
| SCHEMBL7920376 | 0.88 | HTR1A (0.41) | HTR1AALDH1A1CYP3A4CYP2D6TSHR | |
| SCHEMBL6979029 | 0.86 | LMNA (0.43) | HTR1AALDH1A1CYP3A4CYP2D6TSHR | |
| SCHEMBL8031227 | 0.82 | HTR1A (0.41) | HTR1AALDH1A1HTR7ADRA1DADRA1A | |
| SCHEMBL15757164 | 0.79 | MAPK1 (0.48) | ALDH1A1CYP3A4CYP2D6TSHRCYP2C9 | |
| SCHEMBL7911444 | 0.79 | ALDH1A1 (0.38) | HTR1AALDH1A1CYP3A4CYP2D6TSHR | |
| SCHEMBL7918389 | 0.78 | HTR1A (0.48) | HTR1AALDH1A1DRD2 | |
| SCHEMBL4231318 | 0.77 | KMT2A (0.40) | ALDH1A1CYP3A4CYP2D6TSHRCYP2C9 | |
| SCHEMBL6978072 | 0.77 | LMNA (0.44) | HTR1AALDH1A1CYP3A4CYP2D6TSHR | |
| SCHEMBL3208378 | 0.76 | CYP2D6 (0.45) | HTR1AALDH1A1CYP3A4CYP2D6TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-6221863-B1 | TREATING DEPRESSION IN A PATIENT | AMERICAN HOME PRODUCTS CORP. | 2001-04-24 | — | — | US | disclosed |
| WO-2000040581-A1 | 3,4-DIHYDRO-2H-BENZO[1,4]OXAZINE DERIVATIVES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-07-13 | — | — | WO | disclosed |