Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.56 |
| ▸ | MEN1 | O00255 | 6/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | RRM1 | P23921 | 1/20 | 0.50 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | F2 | P00734 | 1/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.48 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.48 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3634237 | 0.83 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1KDM4EMAPT | |
| SCHEMBL3634239 | 0.83 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1KDM4EMAPT | |
| SCHEMBL20503340 | 0.80 | KMT2A (0.57) | ALDH1A1KMT2AMEN1KDM4EMAPT | |
| SCHEMBL4883526 | 0.79 | ALDH1A1 (0.55) | ALDH1A1KMT2AMEN1KDM4EMAPT | |
| SCHEMBL12749341 | 0.79 | ALDH1A1 (0.55) | ALDH1A1KMT2AMEN1KDM4EMAPT | |
| SCHEMBL8218297 | 0.78 | KMT2A (0.60) | ALDH1A1KMT2AMEN1KDM4EMAPT | |
| SCHEMBL18173200 | 0.77 | ALDH1A1 (0.59) | ALDH1A1KMT2AMEN1KDM4EMAPT | |
| SCHEMBL18173201 | 0.77 | ALDH1A1 (0.59) | ALDH1A1KMT2AMEN1KDM4EMAPT | |
| SCHEMBL10782616 | 0.77 | F2 (0.58) | ALDH1A1KMT2AMEN1KDM4EMAPT | |
| SCHEMBL10782610 | 0.77 | F2 (0.58) | ALDH1A1KMT2AMEN1KDM4EMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113307781-A | Synthetic method of 1,2,3-thiadiazole derivative | 新疆大学 | 2021-08-27 | — | — | CN | claimed |
| CN-113307781-A | Synthetic method of 1,2,3-thiadiazole derivative | 新疆大学 | 2021-08-27 | — | — | CN | disclosed |
| CN-113307781-A | Synthetic method of 1,2,3-thiadiazole derivative | 新疆大学 | 2021-08-27 | — | — | CN | disclosed |