Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | CTSV | O60911 | 4/20 | 0.55 |
| ▸ | CTSL | P07711 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.49 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.49 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3994909 | 1.00 | POLB (0.56) | POLBCTSVCTSLMEN1KMT2A | |
| SCHEMBL6814063 | 0.89 | POLB (0.54) | POLBCTSVCTSLMEN1KMT2A | |
| SCHEMBL650225 | 0.89 | POLB (0.47) | POLBCTSVCTSLMEN1KMT2A | |
| SCHEMBL10409125 | 0.86 | POLB (0.56) | POLBCTSVCTSLMEN1KMT2A | |
| SCHEMBL30008652 | 0.86 | CTSV (0.58) | POLBCTSVCTSLMEN1KMT2A | |
| SCHEMBL4126272 | 0.86 | CTSV (0.58) | POLBCTSVCTSLMEN1KMT2A | |
| SCHEMBL27792044 | 0.86 | POLB (0.56) | POLBCTSVCTSLMEN1KMT2A | |
| SCHEMBL4290434 | 0.84 | POLB (0.55) | POLBCTSVCTSLMEN1KMT2A | |
| SCHEMBL16345929 | 0.84 | POLB (0.50) | POLBCTSVCTSLMEN1KMT2A | |
| SCHEMBL31473699 | 0.84 | POLB (0.57) | POLBCTSVCTSLMEN1KMT2A |
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-117440947-A | Lignan derivative, preparation method and application thereof | 中国科学院上海药物研究所 | 2024-01-23 | — | — | CN | disclosed |
| WO-2022222686-A1 | LIGNAN DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF | 中国科学院上海药物研究所 | 2022-10-27 | — | — | WO | disclosed |
| CN-115215821-A | Lignan derivative, preparation method and application thereof | 中国科学院上海药物研究所 | 2022-10-21 | — | — | CN | disclosed |