Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 6/20 | 0.55 |
| ▸ | HTR1B | P28222 | 6/20 | 0.45 |
| ▸ | HTR1D | P28221 | 4/20 | 0.45 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.45 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.45 |
| ▸ | PRKACA | P17612 | 1/20 | 0.44 |
| ▸ | PRKACG | P22612 | 1/20 | 0.44 |
| ▸ | PRKACB | P22694 | 1/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7671809 | 0.81 | ALDH1A1 (0.48) | DRD2HTR2AHTR7KCNH2 | |
| SCHEMBL7678792 | 0.77 | ALDH1A1 (0.47) | HTR6HTR1BDRD2HTR2AHTR7 | |
| SCHEMBL7677414 | 0.77 | OPRM1 (0.46) | CAMK2DPRKACAPRKACGPRKACBDRD2 | |
| SCHEMBL7678632 | 0.76 | TACR2 (0.50) | DRD2HTR2AHTR7KCNH2 | |
| SCHEMBL7677881 | 0.73 | HTR1A (0.57) | HTR6HTR1BHTR2AHTR7HTR1A | |
| SCHEMBL7299257 | 0.72 | CYP2D6 (0.64) | HTR6GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL27712671 | 0.72 | HTR6 (0.76) | HTR6HTR1BHTR1DDRD2HTR2A | |
| SCHEMBL772623 | 0.71 | HTR6 (1.00) | HTR6HTR1BHTR1DGABRA1GABRG2 | |
| SCHEMBL29827369 | 0.71 | HTR6 (1.00) | HTR6HTR1BHTR1DGABRA1GABRG2 | |
| SCHEMBL798334 | 0.71 | HTR6 (1.00) | HTR6HTR1BHTR1DGABRA1GABRG2 |
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-6472418-B1 | Non-peptide NK1 receptors antagonists | WARNER-LAMBERT COMPANY | 2002-10-29 | — | — | US | disclosed |