Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 4/20 | 0.36 |
| ▸ | PDE4A | P27815 | 3/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.36 |
| ▸ | DHODH | Q02127 | 6/20 | 0.33 |
| ▸ | MGLL | Q99685 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 5/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | TYMP | P19971 | 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 | |
|---|---|---|---|---|
| SCHEMBL29085630 | 0.91 | PDE4B (0.35) | PDE4BPDE4APDE4CPDE4DDHODH | |
| Benzene SCHEMBL29188551 | 0.81 | — | — | |
| Boric Acid SCHEMBL23928392 | 0.79 | MGLL (0.41) | DHODHMGLLCA1CA2DHFR | |
| Boric Acid SCHEMBL6065759 | 0.79 | MGLL (0.41) | DHODHMGLLCA1CA2DHFR | |
| SCHEMBL31357415 | 0.79 | PDE4B (0.33) | PDE4BPDE4APDE4CPDE4DMGLL | |
| SCHEMBL29892585 | 0.78 | CA1 (0.36) | CA1CA2LMNAMAPT | |
| Diphenylether SCHEMBL31268381 | 0.77 | CA1 (0.47) | CA1CA2MAPT | |
| Toluene SCHEMBL21249077 | 0.77 | LMNA (0.42) | CA2LMNAMAPTHTT | |
| SCHEMBL29185068 | 0.77 | — | — | |
| SCHEMBL7711087 | 0.76 | ALDH1A1 (0.50) | DHODHDHFRLMNAMAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-111094385-B | Charge-transporting compound, composition containing charge-transporting compound, and organic electroluminescent element using same | 三菱化学株式会社 | 2024-04-09 | — | — | CN | disclosed |