Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.44 |
| ▸ | ACR | P10323 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | F2 | P00734 | 2/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27716736 | 0.92 | MAPT (0.49) | KMT2AMAPTMEN1TDP1NPC1 | |
| SCHEMBL30358192 | 0.84 | KMT2A (0.78) | KMT2AMAPTMEN1TDP1ALDH1A1 | |
| SCHEMBL28749914 | 0.80 | TDP1 (0.39) | KMT2AMAPTMEN1TDP1NPC1 | |
| SCHEMBL8496209 | 0.78 | ALDH1A1 (0.58) | MAPTALDH1A1CA1CA2CYP1A2 | |
| SCHEMBL29038955 | 0.78 | ALDH1A1 (0.58) | MAPTALDH1A1CA1CA2CYP1A2 | |
| SCHEMBL27945114 | 0.77 | KMT2A (0.71) | KMT2AMAPTMEN1TDP1RAB9A | |
| SCHEMBL27858102 | 0.77 | KMT2A (0.75) | KMT2AMAPTMEN1TDP1RAB9A | |
| SCHEMBL31365678 | 0.77 | KMT2A (0.75) | KMT2AMAPTMEN1TDP1RAB9A | |
| SCHEMBL16660304 | 0.77 | MMP3 (0.43) | KMT2AMAPTMEN1NPC1RAB9A | |
| SCHEMBL11038259 | 0.77 | NPC1 (0.56) | KMT2AMAPTMEN1TDP1NPC1 |
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-119504911-A | Cucurbitacin B ester derivative and application thereof in medicines for resisting various cancer cells | 常州大学 | 2025-02-25 | — | — | CN | claimed |
| CN-119504911-A | Cucurbitacin B ester derivative and application thereof in medicines for resisting various cancer cells | 常州大学 | 2025-02-25 | — | — | CN | disclosed |