Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14067191 | 0.88 | SIGMAR1 (0.47) | HRH3SIGMAR1CYP1A2 | |
| SCHEMBL20333472 | 0.87 | HRH3 (0.56) | HRH3SIGMAR1CYP1A2MAPK1SMN1; SMN2 | |
| SCHEMBL18024037 | 0.86 | SIGMAR1 (0.47) | HRH3SIGMAR1CYP1A2MAPK1SMN1; SMN2 | |
| SCHEMBL18024013 | 0.86 | SIGMAR1 (0.47) | HRH3SIGMAR1CYP1A2MAPK1SMN1; SMN2 | |
| SCHEMBL11730463 | 0.84 | SIGMAR1 (0.48) | HRH3SIGMAR1CYP1A2MAPK1SMN1; SMN2 | |
| SCHEMBL11717752 | 0.84 | SIGMAR1 (0.48) | HRH3SIGMAR1CYP1A2MAPK1SMN1; SMN2 | |
| SCHEMBL17526223 | 0.83 | SIGMAR1 (0.55) | HRH3SIGMAR1 | |
| SCHEMBL17526227 | 0.83 | SIGMAR1 (0.55) | HRH3SIGMAR1 | |
| SCHEMBL3051235 | 0.82 | HRH3 (0.42) | HRH3SIGMAR1CYP1A2MAPK1SMN1; SMN2 | |
| SCHEMBL791887 | 0.82 | HRH3 (0.50) | HRH3SIGMAR1CYP1A2MAPK1SMN1; SMN2 |
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-2022166920-A1 | PYRROLOPYRIDAZINE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 杭州中美华东制药有限公司 | 2022-08-11 | — | — | WO | disclosed |