Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.50 |
| ▸ | ALPL | P05186 | 1/20 | 0.50 |
| ▸ | ALPI | P09923 | 1/20 | 0.50 |
| ▸ | ALPG | P10696 | 1/20 | 0.50 |
| ▸ | MPI | P34949 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL595649 | 0.78 | — | — | |
| SCHEMBL3744556 | 0.65 | IDO1 (0.50) | ALDH1A1KDM4ECYP3A4 | |
| SCHEMBL14416088 | 0.61 | — | — | |
| SCHEMBL1548449 | 0.61 | — | — | |
| SCHEMBL1822949 | 0.61 | — | — | |
| SCHEMBL1083825 | 0.56 | — | — | |
| SCHEMBL7995627 | 0.56 | — | — | |
| SCHEMBL2238449 | 0.56 | — | — | |
| SCHEMBL1999085 | 0.56 | — | — | |
| SCHEMBL18965499 | 0.56 | — | — |
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-3762369-B1 | A PROCESS FOR PREPARATION OF FUNGICIDALLY ACTIVE TRIAZOLE COMPOUNDS | UPL LTD (IN) | 2024-12-11 | — | — | EP | disclosed |
| CN-114805227-B | Preparation method of dithio-ditriazole compound | 山东海利尔化工有限公司 | 2023-11-21 | — | — | CN | disclosed |
| CN-114805227-A | Preparation method of dithio-bis-triazole compound | 山东海利尔化工有限公司 | 2022-07-29 | — | — | CN | disclosed |
| WO-2012031183-A2 | MODIFIED FILLERS AND ELASTOMERIC COMPOSITES COMPRISING SAME | CABOT CORPORATION (US) | 2012-03-08 | — | — | WO | disclosed |