Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 2/20 | 0.61 |
| ▸ | RXRB | P28702 | 2/20 | 0.61 |
| ▸ | RXRG | P48443 | 2/20 | 0.61 |
| ▸ | DHODH | Q02127 | 1/20 | 0.54 |
| ▸ | KIF11 | P52732 | 5/20 | 0.50 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.50 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.50 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.50 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.50 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.50 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.46 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.46 |
| ▸ | P2RY14 | Q15391 | 2/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4835788 | 0.86 | CES2 (0.59) | RXRARXRBRXRGKIF11CES2 | |
| SCHEMBL893254 | 0.84 | DHODH (0.57) | RXRARXRBRXRGDHODHKIF11 | |
| SCHEMBL23326915 | 0.83 | DHODH (0.72) | RXRARXRBRXRGDHODHKIF11 | |
| SCHEMBL15744633 | 0.81 | RXRA (0.71) | RXRARXRBRXRGKIF11CES2 | |
| SCHEMBL72091 | 0.80 | CES2 (0.67) | KIF11CES2CES1MAOBNR4A1 | |
| SCHEMBL12937177 | 0.79 | KIF11 (0.67) | RXRARXRBRXRGDHODHKIF11 | |
| SCHEMBL3062844 | 0.79 | DHODH (0.72) | RXRARXRBRXRGDHODHKIF11 | |
| SCHEMBL26033093 | 0.77 | P2RY14 (0.78) | RXRARXRBRXRGKIF11P2RY14 | |
| SCHEMBL30469526 | 0.76 | RXRA (0.74) | RXRARXRBRXRGDHODHP2RY14 | |
| SCHEMBL25560565 | 0.76 | RXRA (0.74) | RXRARXRBRXRGDHODHP2RY14 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114656433-A | Thioisoprophorone bridge modified double-donor organic optical nonlinear chromophore and synthetic method and application thereof | 广州大学 | 2022-06-24 | — | — | CN | claimed |
| CN-114656433-A | Thioisoprophorone bridge modified double-donor organic optical nonlinear chromophore and synthetic method and application thereof | 广州大学 | 2022-06-24 | — | — | CN | disclosed |