Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 5/20 | 0.41 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.33 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.33 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.33 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | KHK | P50053 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 1/20 | 0.32 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.30 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.30 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.30 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.30 |
| ▸ | S1PR3 | Q99500 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8298240 | 0.81 | VCAM1 (0.44) | VCAM1TRPV4CYP1A2MAPTALOX15 | |
| SCHEMBL23084780 | 0.78 | TRPV4 (0.41) | TRPV4DAOKHKIDH1MRGPRX4 | |
| SCHEMBL7744980 | 0.76 | TDP1 (0.42) | VCAM1MAPTALOX15ALDH1A1 | |
| SCHEMBL2725043 | 0.74 | TRPV4 (0.38) | TRPV4DAOKHKIDH1MRGPRX4 | |
| SCHEMBL297085 | 0.73 | MRGPRX4 (0.41) | TRPV4MRGPRX4KCNQ3KCNQ2KCNE1 | |
| SCHEMBL8299347 | 0.73 | TRPV4 (0.41) | VCAM1TRPV4CYP1A2MAPTALOX15 | |
| SCHEMBL1725293 | 0.72 | VCAM1 (0.51) | VCAM1TRPV4CYP1A2MAPTALOX15 | |
| SCHEMBL2731351 | 0.72 | TRPV4 (0.39) | TRPV4DAOKHKMRGPRX4CYP11B1 | |
| SCHEMBL8462168 | 0.71 | TRPV4 (0.52) | VCAM1TRPV4KHKCYP11B1CYP11B2 | |
| SCHEMBL8299664 | 0.71 | TRPV4 (0.49) | VCAM1TRPV4DAOCYP11B1CYP11B2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1227545-A | 3-cyanoaryl pyrazoles and use thereof as herbicides | BAYER AG (DE) | 1999-09-01 | — | — | CN | disclosed |
| EP-0906285-A1 | 3-CYANOARYL PYRAZOLES AND USE THEREOF AS HERBICIDES | BAYER AG (DE) | 1999-04-07 | — | — | EP | disclosed |
| WO-1997046535-A1 | 3-CYANOARYL PYRAZOLES AND USE THEREOF AS HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-12-11 | — | — | WO | disclosed |