Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28239238 | 0.84 | CYP1A2 (0.63) | CYP1A2ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL28239168 | 0.82 | MAPT (0.45) | CYP1A2ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL28238186 | 0.82 | NPC1 (0.47) | CYP1A2ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL28280836 | 0.81 | MEN1 (0.59) | CYP1A2ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL28239457 | 0.80 | POLB (0.55) | CYP1A2ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL28282155 | 0.77 | KDM4E (0.46) | CYP1A2ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL28282172 | 0.74 | KMT2A (0.46) | CYP1A2ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL28863093 | 0.72 | KDM4E (0.45) | CYP1A2ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL28238300 | 0.72 | ATM (0.44) | CYP1A2ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL28280837 | 0.70 | PKM (0.60) | CYP1A2ALDH1A1SMN1; SMN2MAPTMEN1 |
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-108358896-A | A kind of compound and preparation method being used to prepare prevention crop pathogenic bacteria drug | 贵州大学 | 2018-08-03 | — | — | CN | disclosed |