Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 7/20 | 0.42 |
| ▸ | HTR2A | P28223 | 7/20 | 0.42 |
| ▸ | HTR1A | P08908 | 6/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.41 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4729073 | 0.95 | DRD2 (0.43) | GRM5CA12CA9DRD2HTR2A | |
| SCHEMBL4728027 | 0.88 | DRD2 (0.52) | DRD2HTR2AHTR1AKCNH2KDR | |
| SCHEMBL1036450 | 0.85 | KCNA5 (0.53) | GRM5DRD2MAOBKCNA5 | |
| SCHEMBL31436517 | 0.85 | GRM5 (0.42) | GRM5CA12CA9DRD2HTR2A | |
| SCHEMBL14216502 | 0.85 | AURKA (0.46) | GRM5CA12CA9AURKAKDR | |
| SCHEMBL4727033 | 0.84 | DRD2 (0.53) | DRD2HTR2AHTR1AKCNH2SLC6A4 | |
| SCHEMBL14216504 | 0.84 | MAPKAPK2 (0.45) | GRM5CA12CA9DRD2HTR2A | |
| Hydrochloric Acid SCHEMBL12503031 | 0.84 | DAPK3 (0.43) | GRM5CA12CA9DRD2HTR2A | |
| SCHEMBL6583935 | 0.83 | MAOB (0.47) | DRD2MAOBKCNA5GSK3BHRH3 | |
| SCHEMBL26029646 | 0.81 | TDP1 (0.43) | GRM5CA12CA9AURKAKDR |
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-2008020306-A2 | ISOINDOLE DERIVATIVES | PFIZER PRODUCTS INC. (US) | 2008-02-21 | — | — | WO | disclosed |