Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 2/20 | 0.55 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.55 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22070494 | 0.88 | CA12 (0.45) | CYP4F2CYP4A11CA12CA1CA2 | |
| SCHEMBL23309243 | 0.88 | CA12 (0.45) | CYP4F2CYP4A11CA12CA1CA2 | |
| SCHEMBL10686599 | 0.87 | SLC6A3 (0.49) | CA12CA1CA2CA9MAPT | |
| SCHEMBL6082774 | 0.83 | ALDH1A1 (0.55) | MAPTPKMALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL15235893 | 0.83 | ALDH1A1 (0.55) | MAPTPKMALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL15977387 | 0.83 | ALDH1A1 (0.55) | MAPTPKMALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL15428491 | 0.82 | MAPT (0.47) | CA12CA1CA2CA9MAPT | |
| SCHEMBL433974 | 0.82 | MAPT (0.47) | CA12CA1CA2CA9MAPT | |
| SCHEMBL14244289 | 0.82 | MAPT (0.47) | CA12CA1CA2CA9MAPT | |
| SCHEMBL28600953 | 0.82 | MAPT (0.47) | CA12CA1CA2CA9MAPT |
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-2020162612-A1 | PYRIDINE COMPOUND SUBSTITUTED BY HETEROARYL | 大正製薬株式会社 | 2020-08-13 | — | — | WO | disclosed |