Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.36 |
| ▸ | MPO | P05164 | 3/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6870883 | 0.83 | GABRA1 (0.39) | TAAR1GABRA1GABRB2GPR84MPO | |
| SCHEMBL31627734 | 0.81 | TAAR1 (0.61) | TAAR1GABRA1GABRB2MPOSLC6A4 | |
| SCHEMBL17104164 | 0.81 | TAAR1 (0.61) | TAAR1GABRA1GABRB2MPOSLC6A4 | |
| SCHEMBL28794719 | 0.81 | TAAR1 (0.40) | TAAR1GABRA1GABRB2GPR84MPO | |
| SCHEMBL28521050 | 0.79 | TAAR1 (0.39) | TAAR1GABRA1GABRB2GPR84MPO | |
| SCHEMBL5584389 | 0.78 | TAAR1 (0.41) | TAAR1MPOSLC6A4IDO1AOC3 | |
| SCHEMBL840509 | 0.78 | TAAR1 (0.62) | TAAR1MPOIDO1AOC3HPGD | |
| SCHEMBL17980278 | 0.76 | CA2 (0.39) | TAAR1GABRA1GABRB2GPR84MPO | |
| SCHEMBL30360671 | 0.76 | CA2 (0.39) | TAAR1GABRA1GABRB2GPR84MPO | |
| SCHEMBL28528505 | 0.76 | GABRA1 (0.46) | TAAR1GABRA1GABRB2GPR84MPO |
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-101712654-A | Liquid crystal compound containing fluoropyrimidine and application thereof | SHIJIAZHUANG DEV ZONE YONGSHEN | 2010-05-26 | — | — | CN | disclosed |