Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.63 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR1B | P28222 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | HTR5A | P47898 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10834316 | 0.90 | TAAR1 (0.69) | TAAR1CHRM2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL13911221 | 0.86 | TAAR1 (0.66) | TAAR1CHRM2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL18939702 | 0.84 | CHRM2 (0.66) | TAAR1CHRM2CYP1A2GLACYP3A4 | |
| SCHEMBL10911917 | 0.82 | TAAR1 (0.60) | TAAR1CHRM2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL91132 | 0.79 | TAAR1 (0.60) | TAAR1SLC6A2SLC6A4SLC6A3AOC3 | |
| SCHEMBL20615042 | 0.78 | CHRM2 (0.52) | TAAR1CHRM2SLC6A2HTR1DHTR2A | |
| SCHEMBL7242770 | 0.78 | TAAR1 (0.60) | TAAR1CHRM2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7242777 | 0.78 | TAAR1 (0.60) | TAAR1CHRM2HIF1ACYP1A2GLA | |
| SCHEMBL24494846 | 0.78 | CHRM2 (0.58) | TAAR1CHRM2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL22762048 | 0.78 | TAAR1 (0.59) | TAAR1CHRM2SLC6A2SLC6A4SLC6A3 |
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-2020247860-A1 | BROAD SPECTRUM ANTIVIRAL COMPOUNDS TARGETING THE SKI COMPLEX | UNIVERSITY OF MARYLAND, BALTIMORE (US) | 2020-12-10 | — | — | WO | disclosed |