Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 1/20 | 0.47 |
| ▸ | CDC7 | O00311 | 1/20 | 0.46 |
| ▸ | ITK | Q08881 | 6/20 | 0.46 |
| ▸ | AKT2 | P31751 | 6/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | PRKACA | P17612 | 3/20 | 0.42 |
| ▸ | PRKACG | P22612 | 3/20 | 0.42 |
| ▸ | PRKACB | P22694 | 3/20 | 0.42 |
| ▸ | RET | P07949 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.41 |
| ▸ | SRC | P12931 | 2/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HTR3B | O95264 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7027575 | 0.77 | ITK (0.48) | ITKNPC1RAB9ARETKDR | |
| SCHEMBL18486291 | 0.73 | AKT2 (0.44) | MAPK14CDC7AKT2PRKACAPRKACG | |
| SCHEMBL12638816 | 0.72 | GSK3B (0.45) | ITKNPC1RAB9ARETKDR | |
| SCHEMBL3778190 | 0.72 | AKT2 (0.48) | MAPK14CDC7AKT2PRKACAPRKACG | |
| SCHEMBL2938675 | 0.72 | AKT2 (0.70) | MAPK14CDC7AKT2PRKACAPRKACG | |
| SCHEMBL5179280 | 0.71 | ITK (0.61) | ITKNPC1RAB9ARETKDR | |
| SCHEMBL7027583 | 0.71 | MAPT (0.54) | MAPK14AKT2MEN1MAPTKMT2A | |
| SCHEMBL18486241 | 0.70 | PIK3CA (0.46) | MAPK14CDC7AKT2NPC1RAB9A | |
| SCHEMBL5249228 | 0.70 | GSK3B (0.48) | ITKNPC1RAB9ARETKDR | |
| SCHEMBL2396572 | 0.70 | CDK2 (0.44) | ITKNPC1RAB9AKDRGSK3B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002018404-A9 | NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C | HOFFMANN LA ROCHE (CH) | 2003-10-02 | — | — | WO | disclosed |
| EP-1315736-A2 | NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C | F. HOFFMANN-LA ROCHE AG (CH) | 2003-06-04 | — | — | EP | disclosed |
| WO-2002018404-A2 | NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C | F. HOFFMANN-LA ROCHE AG (CH) | 2002-03-07 | — | — | WO | disclosed |