Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | PAOX | Q6QHF9 | 2/20 | 0.33 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.33 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.33 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | HRH2 | P25021 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Urea SCHEMBL4966379 | 0.92 | CYP2C9 (0.40) | CYP2C9CYP2C19MAPTTDP1CHRM2 | |
| Bicarbonate SCHEMBL30077198 | 0.92 | CYP2C9 (0.40) | CYP2C9CYP2C19MAPTTDP1CHRM2 | |
| Oxalic Acid SCHEMBL5863149 | 0.89 | CYP2C9 (0.39) | CYP2C9CYP2C19MAPTTDP1CHRM2 | |
| Acetic Acid SCHEMBL3578727 | 0.89 | FFAR3 (0.39) | CYP2C9CYP2C19MAPTTDP1CHRM2 | |
| Acetic Acid SCHEMBL7124420 | 0.89 | FFAR3 (0.39) | CYP2C9CYP2C19MAPTTDP1CHRM2 | |
| Acetic Acid SCHEMBL29175008 | 0.89 | FFAR3 (0.39) | CYP2C9CYP2C19MAPTTDP1CHRM2 | |
| Acetic Acid SCHEMBL11467288 | 0.86 | CYP2C9 (0.37) | CYP2C9CYP2C19MAPTTDP1CHRM2 | |
| Propionic Acid SCHEMBL7118905 | 0.84 | FFAR3 (0.50) | CYP2C9CYP2C19MAPTCHRM2CHRM4 | |
| Carbamic Acid SCHEMBL15212189 | 0.84 | TDP1 (0.48) | CYP2C9CYP2C19TDP1CHRM2PAOX | |
| Maleic Acid SCHEMBL27846658 | 0.82 | MEN1 (0.45) | CYP2C9CYP2C19TDP1GABRR1ALDH1A1 |
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-2007098033-A2 | FEEDBACK PRODRUG | UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC . (US) | 2007-08-30 | — | — | WO | disclosed |