Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 2/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SLC7A5 | Q01650 | 5/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28036664 | 0.87 | HRH1 (0.41) | HRH1TAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL28036219 | 0.84 | TAAR1 (0.39) | TAAR1PPARGPPARALTA4HPLA2G2A | |
| SCHEMBL5323618 | 0.81 | SLC7A5 (0.43) | HRH1TAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL28036216 | 0.77 | PPARG (0.36) | HRH1TAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL9543123 | 0.76 | MTNR1A (0.40) | SLC6A4PPARGPPARALTA4HALDH1A1 | |
| SCHEMBL28819365 | 0.75 | ALDH1A1 (0.41) | HRH1SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL11515377 | 0.74 | TAAR1 (0.44) | TAAR1LTA4HPLA2G2AHTR2A | |
| SCHEMBL28085523 | 0.74 | HRH1 (0.46) | HRH1TAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL28354366 | 0.73 | CYP2D6 (0.50) | SLC6A4SLC6A2SLC6A3KCNH2LTA4H | |
| SCHEMBL7582723 | 0.72 | MTNR1A (0.47) | HRH1TAAR1SLC6A4SLC6A2SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103476745-B | Diamine compound containing sulfonic acid group and method for producing same | NITTO DENKO CORP. (JP) | 2015-09-30 | — | — | CN | disclosed |