Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 3/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.46 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.46 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.46 |
| ▸ | CA1 | P00915 | 4/20 | 0.44 |
| ▸ | CA2 | P00918 | 4/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28154895 | 0.82 | ENPP2 (0.50) | CA1CA2POLBMEN1KMT2A | |
| SCHEMBL18007730 | 0.82 | F2 (0.50) | F2PRSS1PRSS2PRSS3CA1 | |
| SCHEMBL443434 | 0.82 | ALDH1A1 (0.53) | F2PRSS1PRSS2PRSS3CA1 | |
| SCHEMBL10412878 | 0.80 | ALDH1A1 (0.52) | F2PRSS1PRSS2PRSS3CA1 | |
| SCHEMBL31386568 | 0.80 | TSHR (0.52) | F2PRSS1PRSS2PRSS3CA1 | |
| SCHEMBL26088501 | 0.80 | ALDH1A1 (0.52) | F2PRSS1PRSS2PRSS3CA1 | |
| SCHEMBL7607789 | 0.80 | TSHR (0.52) | F2PRSS1PRSS2PRSS3CA1 | |
| SCHEMBL27880968 | 0.80 | KMT2A (0.53) | F2PRSS1PRSS2PRSS3CA1 | |
| SCHEMBL722599 | 0.79 | BCAT1 (0.46) | KMT2ALMNAMAPTALDH1A1HTT | |
| SCHEMBL31215190 | 0.79 | BCAT1 (0.46) | KMT2ALMNAMAPTALDH1A1HTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108191786-B | 2, 5-substituent-1, 3, 4-oxadiazole disulfone derivative, preparation method and application thereof | 贵州大学 | 2021-04-30 | — | — | CN | disclosed |
| CN-108117528-B | 2, 5-substituent-1, 3, 4-oxadiazole sulfone derivative, preparation method and application thereof | 贵州大学 | 2021-04-30 | — | — | CN | disclosed |