Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 2/20 | 0.30 |
| ▸ | CA1 | P00915 | 2/20 | 0.30 |
| ▸ | CA2 | P00918 | 2/20 | 0.30 |
| ▸ | MMP2 | P08253 | 2/20 | 0.30 |
| ▸ | CA9 | Q16790 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16590946 | 0.97 | SHBG (0.42) | SHBGEPHX1CA12CA1CA2 | |
| SCHEMBL3311552 | 0.90 | SHBG (0.39) | SHBGEPHX1CA12CA1CA2 | |
| SCHEMBL10437743 | 0.88 | SHBG (0.43) | SHBGEPHX1CA12CA1CA2 | |
| SCHEMBL3313525 | 0.88 | SHBG (0.43) | SHBGEPHX1CA12CA1CA2 | |
| SCHEMBL4979151 | 0.87 | — | — | |
| SCHEMBL8160857 | 0.84 | SHBG (0.33) | SHBG | |
| SCHEMBL4593053 | 0.84 | SHBG (0.37) | SHBGEPHX1CA12CA1CA2 | |
| SCHEMBL17789899 | 0.80 | SHBG (0.33) | SHBGCA12CA1CA2MMP2 | |
| SCHEMBL10260943 | 0.79 | SHBG (0.36) | SHBGEPHX1 | |
| SCHEMBL17789938 | 0.78 | SHBG (0.37) | SHBGEPHX1CA12CA1CA2 |
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 |