Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 5/20 | 0.64 |
| ▸ | HTR1D | P28221 | 1/20 | 0.64 |
| ▸ | HTR2B | P41595 | 1/20 | 0.64 |
| ▸ | UTS2R | Q9UKP6 | 4/20 | 0.50 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.44 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8995895 | 0.92 | HTR1A (0.73) | HTR1AHTR1DHTR2BKCNQ2CHRM1 | |
| SCHEMBL8995908 | 0.85 | HTR1A (0.64) | HTR1AHTR1DHTR2BCYP1A2CYP2D6 | |
| SCHEMBL8995900 | 0.81 | HTR1A (0.68) | HTR1AHTR1DHTR2BKCNQ2DRD3 | |
| SCHEMBL8065712 | 0.78 | HTR1A (1.00) | HTR1AHTR1DHTR2BCYP3A4CYP1A2 | |
| SCHEMBL6546383 | 0.78 | HTR1A (1.00) | HTR1AHTR1DHTR2BCYP3A4CYP1A2 | |
| SCHEMBL8653841 | 0.75 | HTR1A (0.63) | HTR1AHTR1DHTR2BDRD3ADRA1A | |
| SCHEMBL8653834 | 0.75 | HTR1A (0.63) | HTR1AHTR1DHTR2BKCNQ2DRD3 | |
| SCHEMBL8653021 | 0.75 | HTR1A (0.66) | HTR1AHTR1DHTR2BSLC6A4ADRA1A | |
| SCHEMBL8596494 | 0.75 | HTR1A (0.63) | HTR1AHTR1DHTR2BADRA1ADRD4 | |
| SCHEMBL8652998 | 0.74 | HTR1A (0.62) | HTR1AHTR1DHTR2BDRD3KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5541179-A | Tropon-2-one piperazine carboxamides as serotonergic agents | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-07-30 | — | — | US | disclosed |