Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL17249602 | 0.77 | CHRM1 (0.39) | ALDH1A1MLYCD | |
| SCHEMBL20501492 | 0.77 | ALDH1A1 (0.36) | ALDH1A1MLYCD | |
| SCHEMBL16730612 | 0.75 | DPP4 (0.31) | ALDH1A1MLYCD | |
| SCHEMBL11892785 | 0.73 | MLYCD (0.33) | ALDH1A1MLYCD | |
| SCHEMBL16440233 | 0.71 | CYP3A4 (0.33) | — | |
| SCHEMBL24772215 | 0.70 | ALDH1A1 (0.37) | ALDH1A1MLYCD | |
| SCHEMBL24723654 | 0.69 | DPP4 (0.31) | — | |
| SCHEMBL11890383 | 0.69 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL16437468 | 0.67 | POLB (0.35) | — | |
| SCHEMBL12836249 | 0.67 | — | — |
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 |