Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 5/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 2/20 | 0.48 |
| ▸ | DRD2 | P14416 | 2/20 | 0.48 |
| ▸ | HTR2A | P28223 | 2/20 | 0.48 |
| ▸ | HTR7 | P34969 | 2/20 | 0.48 |
| ▸ | HTR6 | P50406 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 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 | |
|---|---|---|---|---|
| SCHEMBL3718078 | 0.95 | HRH4 (0.54) | HRH4HRH3HTR1ADRD2HTR2A | |
| SCHEMBL3722161 | 0.85 | HRH4 (0.53) | HRH4HTR1ADRD2HTR2AHTR7 | |
| SCHEMBL3719607 | 0.81 | ALDH1A1 (0.50) | HRH4HRH3HTR1ADRD2HTR2A | |
| SCHEMBL3720912 | 0.81 | MAPT (0.49) | L3MBTL1ALDH1A1SMN1; SMN2MAPTKDM4E | |
| SCHEMBL3724664 | 0.80 | HRH4 (0.57) | HRH4HTR1ADRD2HTR2AHTR7 | |
| SCHEMBL3728035 | 0.80 | KDM4E (0.71) | HRH4HRH3L3MBTL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL3720249 | 0.79 | MEN1 (0.47) | DRD2L3MBTL1ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL3717768 | 0.77 | KDM4E (0.57) | ALDH1A1SMN1; SMN2MAPTKDM4EHTT | |
| SCHEMBL3728861 | 0.76 | MAPT (0.54) | HRH4ALDH1A1SMN1; SMN2MAPTKDM4E | |
| SCHEMBL3718071 | 0.74 | KDM4E (0.78) | HRH4HRH3L3MBTL1ALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010141805-A1 | HETEROCYCLIC AMIDES AS MODULATORS OF TRPA1 | JANSSEN PHARMACEUTICA NV (BE) | 2010-12-09 | — | — | WO | disclosed |