Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.50 |
| ▸ | PTGES | O14684 | 6/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | APP | P05067 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | SNCA | P37840 | 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 | |
|---|---|---|---|---|
| SCHEMBL2361558 | 0.89 | PTGES (0.53) | DGAT1MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL13405913 | 0.84 | PTGES (0.46) | DGAT1MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL2361014 | 0.82 | PTGES (0.43) | DGAT1PTGESCYP2C9MAPK14 | |
| SCHEMBL14146990 | 0.82 | PTGES (0.42) | DGAT1MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL13406020 | 0.81 | DGAT1 (0.54) | DGAT1MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL2360765 | 0.81 | NPBWR1 (0.48) | DGAT1PTGESNPBWR1 | |
| SCHEMBL22955324 | 0.80 | KDM4E (0.48) | MEN1KMT2AKDM4EALDH1A1TP53 | |
| SCHEMBL2360992 | 0.78 | PTGES (0.59) | PTGES | |
| SCHEMBL2361393 | 0.78 | PTGES (0.47) | DGAT1PTGESCYP2C9 | |
| SCHEMBL2361320 | 0.78 | PTGES (0.47) | MEN1KMT2AKDM4EALDH1A1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011099832-A2 | NOVEL BENZIMIDAZOLE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | CRYSTALGENOMICS, INC. (KR) | 2011-08-18 | — | — | WO | disclosed |