Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.36 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.36 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.36 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.36 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.36 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.36 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MC4R | P32245 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28294965 | 0.99 | PRKAB2 (0.38) | SIGMAR1PRKAB2PRKAG1PRKAA2PRKAA1 | |
| SCHEMBL28296691 | 0.90 | PARP1 (0.40) | SIGMAR1 | |
| SCHEMBL28296692 | 0.81 | IDO1 (0.41) | IDO1HRH1 | |
| SCHEMBL28294951 | 0.76 | SIGMAR1 (0.41) | SIGMAR1IDO1HTR1ASLC6A2HRH3 | |
| SCHEMBL28689910 | 0.73 | HTR1A (0.44) | HTR1AHTR2A | |
| SCHEMBL28695945 | 0.72 | HTR1A (0.43) | HTR1AHTR2A | |
| SCHEMBL30332563 | 0.67 | IDO1 (0.58) | IDO1ALDH1A1 | |
| SCHEMBL18926549 | 0.65 | LTA4H (0.59) | SIGMAR1HTR1AALDH1A1HRH3HRH1 | |
| SCHEMBL28162876 | 0.65 | SIGMAR1 (0.70) | SIGMAR1SLC6A2 | |
| SCHEMBL28294955 | 0.64 | ACHE (0.53) | SIGMAR1ALDH1A1CYP2D6 |
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-109665987-A | Naphthalene lactim-polyamines conjugate and its preparation method and application | 河南大学 | 2019-04-23 | — | — | CN | disclosed |