Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.63 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28371151 | 0.88 | PTGS2 (0.50) | PTGS2HDAC4HDAC1HDAC2HDAC6 | |
| SCHEMBL28371338 | 0.88 | PTGS2 (0.53) | PTGS2HDAC4HDAC1HDAC2HDAC6 | |
| SCHEMBL28886199 | 0.88 | PTGS2 (0.50) | PTGS2HDAC4HDAC1HDAC2HDAC6 | |
| SCHEMBL28376412 | 0.88 | PTGS2 (0.50) | PTGS2HDAC4HDAC1HDAC2HDAC6 | |
| SCHEMBL6132166 | 0.84 | PTGS2 (0.69) | PTGS2PTGS1LMNAHPGDSMN1; SMN2 | |
| SCHEMBL11376435 | 0.81 | L3MBTL1 (0.62) | PTGS2PTGS1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL28198327 | 0.78 | PTGS2 (0.56) | PTGS2PTGS1LMNAUSP2ALDH1A1 | |
| SCHEMBL11376339 | 0.75 | PTGS1 (0.51) | PTGS2PTGS1LMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL11318935 | 0.75 | PTGS2 (0.52) | PTGS2HDAC4HDAC1HDAC2HDAC6 | |
| SCHEMBL28233689 | 0.72 | LMNA (0.57) | PTGS2PTGS1LMNAALDH1A1TSHR |
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-104910082-B | 3,4, 5-trisubstituted-1, 2, 4-triazole thioether derivative and synthesis method and application thereof | 贵阳学院 | 2020-03-17 | — | — | CN | disclosed |