Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1286042 | 0.90 | MAPT (0.36) | — | |
| SCHEMBL18741093 | 0.88 | MAPT (0.33) | — | |
| SCHEMBL1285999 | 0.87 | POLB (0.33) | CYP3A4 | |
| SCHEMBL1285970 | 0.87 | POLB (0.33) | CYP3A4 | |
| SCHEMBL18740927 | 0.85 | MEN1 (0.33) | CYP1A2CYP2E1CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL5575477 | 0.76 | — | — | |
| SCHEMBL131435 | 0.74 | — | — | |
| SCHEMBL12830678 | 0.73 | MAPT (0.41) | CYP1A2CYP2E1CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL12830677 | 0.73 | MAPT (0.41) | CYP1A2CYP2E1CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL18568777 | 0.73 | CYP2E1 (0.43) | CYP1A2CYP2E1CYP3A4CYP2C8CYP2D6 |
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-2017064243-A1 | USE OF PHTHALOCYANINE COMPOUNDS WITH ARYL OR HETARYL SUBSTITUENTS IN GAS SENSORS | BASF SE (DE) | 2017-04-20 | — | — | WO | disclosed |