Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23430146 | 0.79 | KCNA5 (0.54) | CYP19A1KCNA5KCNH2 | |
| SCHEMBL9494010 | 0.77 | KCNA5 (0.49) | CYP3A4CYP3A5CYP19A1LMNACYP1A2 | |
| SCHEMBL27888098 | 0.76 | CYP19A1 (0.52) | CYP3A4CYP3A5CYP19A1LMNACYP1A2 | |
| SCHEMBL28036808 | 0.75 | CYP19A1 (0.55) | CYP3A4CYP3A5CYP19A1LMNACYP1A2 | |
| SCHEMBL13557773 | 0.75 | CYP19A1 (0.55) | CYP3A4CYP3A5CYP19A1LMNACYP1A2 | |
| SCHEMBL13577 | 0.74 | CYP19A1 (0.57) | CYP3A4CYP3A5CYP19A1CYP1A2KCNA5 | |
| SCHEMBL29387897 | 0.74 | CYP19A1 (0.57) | CYP3A4CYP3A5CYP19A1CYP1A2KCNA5 | |
| SCHEMBL7068828 | 0.74 | CYP19A1 (0.57) | CYP3A4CYP3A5CYP19A1CYP1A2KCNA5 | |
| SCHEMBL18700743 | 0.74 | ALDH1A1 (0.48) | CYP3A4LMNACYP1A2 | |
| SCHEMBL24342382 | 0.74 | ALDH1A1 (0.48) | CYP3A4LMNACYP1A2 |
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-2022171166-A1 | AZAHETEROARYL COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 上海青煜医药科技有限公司 | 2022-08-18 | — | — | WO | disclosed |