Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT6 | Q8N6T7 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | GFER | P55789 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28170767 | 0.85 | AKR1C3 (0.58) | SIRT6ALDH1A1KMT2AGFERKDM4E | |
| SCHEMBL5722125 | 0.83 | ALDH1A1 (0.64) | SIRT6ALDH1A1KMT2AGFERKDM4E | |
| SCHEMBL3122573 | 0.82 | LMNA (0.61) | ALDH1A1KMT2AGFERKDM4EGAA | |
| Hydrochloric Acid SCHEMBL27788243 | 0.80 | LMNA (0.59) | ALDH1A1KMT2AGFERKDM4EGAA | |
| SCHEMBL1794248 | 0.80 | HTR2C (0.51) | SIRT6ALDH1A1KMT2AGAAMAPT | |
| SCHEMBL17899709 | 0.79 | KMT2A (0.50) | SIRT6ALDH1A1KMT2AGFERKDM4E | |
| SCHEMBL31531621 | 0.77 | ALDH1A1 (0.71) | SIRT6ALDH1A1KDM4ELMNATP53 | |
| Hydrochloric Acid SCHEMBL27788123 | 0.77 | PKM (0.64) | ALDH1A1KMT2AKDM4EMAPTLMNA | |
| Hydrochloric Acid SCHEMBL7652831 | 0.76 | LMNA (0.54) | ALDH1A1KMT2AGFERKDM4EGAA | |
| SCHEMBL6878147 | 0.76 | RORC (0.49) | ALDH1A1KMT2AKDM4EGAALMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1432417-A2 | SUBSTITUTED BENZIMIDAZOLE COMPOUNDS AND THEIR USE FOR THE TREATMENT OF CANCER | Aventis Pharma S.A. (FR) | 2004-06-30 | — | — | EP | disclosed |
| WO-2003028721-A2 | SUBSTITUTED BENZIMIDAZOLE COMPOUNDS AND THEIR USE FOR THE TREATMENT OF CANCER | AVENTIS PHARMA S.A. (FR) | 2003-04-10 | — | — | WO | disclosed |