Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8095627 | 0.84 | LTA4H (0.53) | TAAR1LTA4HSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL1231042 | 0.83 | TAAR1 (0.50) | TAAR1TSHRACHECYP1A2CYP3A4 | |
| SCHEMBL275838 | 0.81 | CALM1 (0.55) | TAAR1LTA4HTSHRACHEMEN1 | |
| SCHEMBL29940610 | 0.81 | CALM1 (0.55) | TAAR1LTA4HTSHRACHEMEN1 | |
| SCHEMBL9741301 | 0.81 | CALM1 (0.55) | TAAR1LTA4HTSHRACHEMEN1 | |
| SCHEMBL2847801 | 0.80 | TAAR1 (0.47) | TAAR1SMN1; SMN2CHRM2ALDH1A1HPGD | |
| SCHEMBL10863097 | 0.79 | CALM1 (0.52) | TAAR1LTA4HTSHRMEN1CYP1A2 | |
| Hydrochloric Acid SCHEMBL21175607 | 0.79 | CALM1 (0.52) | TAAR1LTA4HTSHRMEN1CYP1A2 | |
| SCHEMBL27614158 | 0.79 | CALM1 (0.52) | TAAR1LTA4HTSHRACHEMEN1 | |
| SCHEMBL28844984 | 0.78 | TAAR1 (0.39) | TAAR1ARTSHRACHECYP1A2 |
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-107001415-B | Cytotoxic and antimitotic compounds, and methods of use thereof | 酵活有限公司 | 2021-06-18 | — | — | CN | disclosed |