Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.35 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28290789 | 0.85 | ALDH1A1 (0.57) | ALDH1A1PKMKMT2AMITFSOS1 | |
| SCHEMBL28290761 | 0.84 | MITF (0.62) | ALDH1A1PKMKMT2AMITFSOS1 | |
| SCHEMBL2878422 | 0.81 | ALDH1A1 (0.50) | ALDH1A1PKMKMT2AMITFSOS1 | |
| SCHEMBL4058834 | 0.81 | ALDH1A1 (0.62) | ALDH1A1PKMKMT2AMITFSOS1 | |
| SCHEMBL28290784 | 0.79 | ALDH1A1 (0.53) | ALDH1A1PKMKMT2AMITFSOS1 | |
| SCHEMBL28290767 | 0.78 | L3MBTL1 (0.44) | ALDH1A1PKMKMT2AMITFPOLB | |
| SCHEMBL27726671 | 0.77 | ALDH1A1 (0.50) | ALDH1A1PKMKMT2AMITFSOS1 | |
| SCHEMBL18026616 | 0.76 | ALDH1A1 (0.64) | ALDH1A1PKMKMT2AMITFSOS1 | |
| SCHEMBL3504600 | 0.76 | ALDH1A1 (0.68) | ALDH1A1PKMKMT2AMITFSOS1 | |
| SCHEMBL28334488 | 0.76 | ALDH1A1 (0.68) | ALDH1A1PKMKMT2AMITFSOS1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109706198-A | A kind of method that online enzyme process closes nitro imidazole derivatives | 浙江工业大学 | 2019-05-03 | — | — | CN | disclosed |