Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.41 |
| ▸ | VCAM1 | P19320 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.30 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.30 |
| ▸ | GRIA3 | P42263 | 2/20 | 0.30 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.30 |
| ▸ | GRM6 | O15303 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | XDH | P47989 | 1/20 | 0.30 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.30 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17345635 | 0.81 | ALDH1A1 (0.38) | ALDH1A1CYP1A2MAPTCYP3A4CYP2C19 | |
| SCHEMBL5963451 | 0.74 | ALDH1A1 (0.35) | VCAM1ALDH1A1CYP1A2MAPTCYP3A4 | |
| SCHEMBL2731419 | 0.74 | TRPV4 (0.47) | TRPV4AKR1B1DAO | |
| SCHEMBL13766377 | 0.73 | TRPV4 (0.50) | TRPV4AKR1B1DAO | |
| SCHEMBL8298554 | 0.73 | VCAM1 (0.41) | TRPV4VCAM1ALDH1A1GRIA1GRIA2 | |
| SCHEMBL4614436 | 0.70 | VCAM1 (0.47) | TRPV4VCAM1ALDH1A1GRIA1GRIA2 | |
| SCHEMBL8298240 | 0.70 | VCAM1 (0.44) | TRPV4VCAM1ALDH1A1GRIA1GRIA2 | |
| SCHEMBL365265 | 0.70 | TRPV4 (0.50) | TRPV4AKR1B1 | |
| SCHEMBL3161291 | 0.70 | TRPV4 (0.50) | TRPV4 | |
| SCHEMBL363766 | 0.70 | TRPV4 (0.50) | TRPV4 |
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-0906285-A1 | 3-CYANOARYL PYRAZOLES AND USE THEREOF AS HERBICIDES | BAYER AG (DE) | 1999-04-07 | — | — | EP | disclosed |
| EP-0897383-A1 | 3-CYANOARYL PYRAZOLES AND THEIR USE AS HERBICIDES | BAYER AG (DE) | 1999-02-24 | — | — | EP | disclosed |
| WO-1997046535-A1 | 3-CYANOARYL PYRAZOLES AND USE THEREOF AS HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-12-11 | — | — | WO | disclosed |
| WO-1997040018-A1 | 3-CYANOARYL PYRAZOLES AND THEIR USE AS HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-10-30 | — | — | WO | disclosed |