Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 12/20 | 0.35 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 2/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20107708 | 1.00 | AR (0.35) | ARSLC6A9S1PR1S1PR3S1PR5 | |
| SCHEMBL18854488 | 0.76 | GPR35 (0.37) | ARCYP11B1CYP11B2 | |
| SCHEMBL17028323 | 0.76 | MAP3K7 (0.39) | — | |
| SCHEMBL20107707 | 0.74 | MBOAT4 (0.32) | AR | |
| SCHEMBL20107965 | 0.73 | DHODH (0.37) | ARSLC6A9S1PR1S1PR3S1PR5 | |
| SCHEMBL21463047 | 0.73 | DHODH (0.37) | ARSLC6A9S1PR1S1PR3S1PR5 | |
| SCHEMBL29512855 | 0.73 | DHODH (0.37) | ARSLC6A9S1PR1S1PR3S1PR5 | |
| SCHEMBL28953489 | 0.73 | — | — | |
| SCHEMBL17028248 | 0.73 | CYP11B1 (0.40) | ARCYP11B1CYP11B2 | |
| SCHEMBL21853468 | 0.72 | DHODH (0.38) | SLC6A9DHODH |
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-110023302-B | 2,4, 5-trisubstituted 1,2, 4-triazolones as DHODH inhibitors | 拜耳股份有限公司 | 2022-07-26 | — | — | CN | disclosed |