Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | NQO2 | P16083 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.41 |
| ▸ | CDYL | Q9Y232 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL714592 | 0.92 | CYP1A2 (0.46) | CYP1A2CYP2C19CYP2D6NQO2MTNR1A | |
| SCHEMBL29825535 | 0.92 | CYP1A2 (0.46) | CYP1A2CYP2C19CYP2D6NQO2MTNR1A | |
| SCHEMBL11431707 | 0.83 | CYP1A2 (0.43) | CYP1A2CYP2C19CYP2D6NQO2MTNR1A | |
| SCHEMBL18204484 | 0.81 | L3MBTL1 (0.39) | CYP1A2CYP2C19CYP2D6NQO2MTNR1A | |
| SCHEMBL3720960 | 0.78 | KDM4E (0.37) | CYP1A2NQO2MTNR1AKDM4EDAO | |
| SCHEMBL29846915 | 0.76 | MIF (0.39) | GABRA1GABRB2 | |
| SCHEMBL111243 | 0.76 | MIF (0.39) | GABRA1GABRB2 | |
| SCHEMBL7525986 | 0.76 | KEAP1 (0.53) | CYP1A2CYP2C19CYP2D6NQO2MTNR1A | |
| SCHEMBL1848951 | 0.75 | CYP1A2 (0.48) | CYP1A2CYP2C19CYP2D6NQO2MTNR1A | |
| SCHEMBL10433882 | 0.75 | GABRA1 (0.41) | GABRA1GABRB2DAO |
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-2003095581-A1 | FLUORINATED ACTIVATOR | PRC-DESOTO INTERNATIONAL, INC. (US) | 2003-11-20 | — | — | WO | disclosed |