Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.60 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.60 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.60 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5546903 | 0.80 | PDK1 (0.71) | PDK1PDK2PDK3PDK4NPC1 | |
| SCHEMBL31490980 | 0.79 | PDK1 (0.69) | PDK1PDK2PDK3PDK4NPC1 | |
| SCHEMBL11356431 | 0.75 | L3MBTL1 (0.73) | PDK1PDK2PDK3PDK4NPC1 | |
| Nitric Acid SCHEMBL27720595 | 0.74 | IDO1 (0.60) | NPC1RAB9ASMN1; SMN2ALOX5ALDH1A1 | |
| SCHEMBL6928361 | 0.74 | NPC1 (0.63) | PDK1PDK2PDK3PDK4NPC1 | |
| SCHEMBL31745201 | 0.74 | PDK1 (0.66) | PDK1PDK2PDK3PDK4NPC1 | |
| SCHEMBL4128446 | 0.72 | MEN1 (0.77) | NPC1RAB9ASMN1; SMN2ALOX5ALDH1A1 | |
| SCHEMBL6825635 | 0.72 | L3MBTL1 (0.61) | NPC1RAB9ASMN1; SMN2ALOX5ALDH1A1 | |
| SCHEMBL11092496 | 0.70 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2MAPTMEN1 | |
| SCHEMBL6396790 | 0.70 | RAB9A (0.76) | NPC1RAB9ASMN1; SMN2ALDH1A1MAPT |
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-103819409-A | Preparation method of 5-difluoromethoxy-2-mercapto-1H-benzimidazole | SHENYANG MANWEI CHEMICAL CO LTD | 2014-05-28 | — | — | CN | claimed |
| CN-103819409-A | Preparation method of 5-difluoromethoxy-2-mercapto-1H-benzimidazole | SHENYANG MANWEI CHEMICAL CO LTD | 2014-05-28 | — | — | CN | disclosed |