Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9544686 | 0.99 | NPSR1 (0.35) | NPSR1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL9212738 | 0.96 | NPSR1 (0.35) | NPSR1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL9544909 | 0.92 | NPSR1 (0.36) | NPSR1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL9208815 | 0.92 | NPSR1 (0.36) | NPSR1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL9216963 | 0.88 | NPSR1 (0.38) | NPSR1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL9215296 | 0.86 | NPSR1 (0.35) | NPSR1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL9544863 | 0.86 | NPSR1 (0.35) | NPSR1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL9215150 | 0.85 | NPSR1 (0.35) | NPSR1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL9219291 | 0.84 | NPSR1 (0.36) | NPSR1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL9544365 | 0.84 | NPSR1 (0.36) | NPSR1CYP1A2CYP3A4GAACYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0644879-A1 | HERBICIDAL PYRAZOLE-(THIO)-CARBOXAMIDES | RHONE POULENC AGRICULTURE LTD. (GB) | 1995-03-29 | — | — | EP | claimed |
| WO-1993025535-A1 | HERBICIDAL PYRAZOLE-(THIO)-CARBOXAMIDES | RHONE POULENC AGRICULTURE LTD. (GB) | 1993-12-23 | — | — | WO | claimed |
| EP-0644879-A1 | HERBICIDAL PYRAZOLE-(THIO)-CARBOXAMIDES | RHONE POULENC AGRICULTURE LTD. (GB) | 1995-03-29 | — | — | EP | disclosed |
| WO-1993025535-A1 | HERBICIDAL PYRAZOLE-(THIO)-CARBOXAMIDES | RHONE POULENC AGRICULTURE LTD. (GB) | 1993-12-23 | — | — | WO | disclosed |