Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.52 |
| ▸ | MMP2 | P08253 | 4/20 | 0.52 |
| ▸ | CA12 | O43570 | 4/20 | 0.52 |
| ▸ | CA9 | Q16790 | 4/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.52 |
| ▸ | MMP1 | P03956 | 2/20 | 0.52 |
| ▸ | MMP9 | P14780 | 2/20 | 0.52 |
| ▸ | MMP13 | P45452 | 2/20 | 0.52 |
| ▸ | MMP3 | P08254 | 1/20 | 0.52 |
| ▸ | MMP7 | P09237 | 1/20 | 0.52 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.51 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.51 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | MMP8 | P22894 | 1/20 | 0.50 |
| ▸ | CA3 | P07451 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29196172 | 0.84 | KMT2A (0.57) | CA2MMP2CA12CA9CA14 | |
| SCHEMBL9594962 | 0.83 | MMP2 (0.50) | CA2MMP2CA12CA9CA14 | |
| SCHEMBL13405184 | 0.81 | MMP2 (0.46) | CA2MMP2CA12CA9CA14 | |
| SCHEMBL29196167 | 0.81 | KMT2A (0.54) | CA2MMP2CA12CA9CA14 | |
| SCHEMBL5134084 | 0.80 | BACE1 (0.57) | MMP2MMP9MAPTL3MBTL1ALDH1A1 | |
| SCHEMBL5041194 | 0.80 | BACE1 (0.57) | MMP2MMP9MAPTL3MBTL1ALDH1A1 | |
| SCHEMBL11853731 | 0.80 | KMT2A (0.57) | CA2MMP2CA12CA9CA14 | |
| SCHEMBL29196169 | 0.80 | ALDH1A1 (0.58) | CA2MMP2CA12CA9CA14 | |
| SCHEMBL3152558 | 0.78 | KMT2A (0.62) | CA2MMP2CA12CA9CA14 | |
| SCHEMBL22492367 | 0.78 | ALDH1A1 (0.60) | CA2MMP2CA12CA9CA14 |
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-117924137-A | Azetidine diester and preparation method and application thereof | 南宁师范大学 | 2024-04-26 | — | — | CN | disclosed |
| CN-105481748-A | 5-fluoro polysubstituted pyrroline derivative and preparation method thereof | UNIV EAST CHINA NORMAL | 2016-04-13 | — | — | CN | disclosed |