Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 8/20 | 0.39 |
| ▸ | CTSS | P25774 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | GLS | O94925 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL15511852 | 0.85 | CA1 (0.46) | CA1CA2CA7CYP2D6KMT2A | |
| SCHEMBL28078949 | 0.85 | CA1 (0.46) | CA1CA2CA7CYP2D6KMT2A | |
| SCHEMBL21985407 | 0.85 | CA1 (0.50) | CA1CA2CA7CYP2D6KMT2A | |
| SCHEMBL15014014 | 0.85 | CA1 (0.46) | CA1CA2CA7CYP2D6KMT2A | |
| SCHEMBL16654059 | 0.85 | CA1 (0.46) | CA1CA2CA7CYP2D6KMT2A | |
| SCHEMBL19209613 | 0.85 | CA1 (0.46) | CA1CA2CA7CYP2D6KMT2A | |
| SCHEMBL15014015 | 0.85 | CA1 (0.46) | CA1CA2CA7CYP2D6KMT2A | |
| SCHEMBL15511851 | 0.85 | CA1 (0.46) | CA1CA2CA7CYP2D6KMT2A | |
| SCHEMBL21341197 | 0.83 | CTSK (0.46) | CA1CA2CA7CYP2D6KMT2A | |
| SCHEMBL16554064 | 0.83 | CA1 (0.44) | CA1CA2CA7CYP2D6KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3240413-B1 | PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY | DOW AGROSCIENCES LLC (US) | 2020-05-13 | — | — | EP | disclosed |