Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 12/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19120270 | 0.81 | GRM5 (0.44) | GRM5KCNH2CYP1A2 | |
| SCHEMBL19120318 | 0.79 | GRM5 (0.50) | GRM5KCNH2CYP1A2 | |
| SCHEMBL19119846 | 0.74 | GRM5 (0.45) | GRM5KCNH2CYP1A2 | |
| Methyl Alcohol SCHEMBL28902013 | 0.67 | GRM5 (0.67) | GRM5KCNH2CYP1A2 | |
| SCHEMBL352291 | 0.67 | GRM5 (0.65) | GRM5KCNH2CYP1A2 | |
| SCHEMBL20623887 | 0.67 | GRM5 (0.43) | GRM5KCNH2CYP1A2 | |
| SCHEMBL19120416 | 0.66 | GRM5 (0.46) | GRM5KCNH2CYP1A2 | |
| SCHEMBL27996721 | 0.64 | GRM5 (0.53) | GRM5KCNH2CYP1A2 | |
| SCHEMBL29610604 | 0.64 | — | — | |
| SCHEMBL5560365 | 0.64 | — | — |
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-2017117708-A1 | PYRAZOLE DERIVATIVES | HUA MEDICINE (SHANGHAI) LTD. (CN) | 2017-07-13 | — | — | WO | disclosed |