Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.39 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.39 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.38 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | PLA2G10 | O15496 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | LCK | P06239 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.37 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.37 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.37 |
| ▸ | SLC1A1 | P43005 | 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 | |
|---|---|---|---|---|
| SCHEMBL28957130 | 0.86 | CA2 (0.47) | EPHX1CA1CA2GRIK1GRIK2 | |
| SCHEMBL7828210 | 0.84 | CA2 (0.46) | EPHX1CA1CA2GRIK1GRIK2 | |
| SCHEMBL20610328 | 0.84 | CA1 (0.48) | EPHX1CA1CA2GRIK1GRIK2 | |
| SCHEMBL25769164 | 0.83 | EPHX1 (0.43) | EPHX1CA1CA2GRIK1GRIK2 | |
| SCHEMBL9676581 | 0.82 | CA1 (0.47) | EPHX1CA1CA2GRIK1GRIK2 | |
| SCHEMBL17501643 | 0.81 | CA2 (0.46) | EPHX1CA1CA2GRIK1GRIK2 | |
| SCHEMBL20746347 | 0.78 | CA1 (0.50) | EPHX1CA1CA2GRIK1GRIK2 | |
| SCHEMBL30679515 | 0.78 | GPR84 (0.45) | EPHX1CA1CA2GRIK1GRIK2 | |
| SCHEMBL17474425 | 0.77 | CA2 (0.46) | EPHX1CA1CA2GRIK1GRIK2 | |
| SCHEMBL572638 | 0.77 | GPR84 (0.48) | EPHX1CA1CA2GRIK1GRIK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1137640-A1 | CYCLIC HYDRAZINE DERIVATIVES AS TNF-ALPHA INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-10-04 | — | — | EP | disclosed |
| WO-2000035885-A1 | CYCLIC HYDRAZINE DERIVATIVES AS TNF-ALPHA INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2000-06-22 | — | — | WO | disclosed |