Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAF1 | P04049 | 1/20 | 0.39 |
| ▸ | CCNC | P24863 | 1/20 | 0.39 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | TEK | Q02763 | 5/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | PORCN | Q9H237 | 6/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13679655 | 0.86 | PTPN1 (0.46) | RAF1HTTALOX5KDM4EPDE3B | |
| SCHEMBL3824756 | 0.85 | SELP (0.40) | RAF1CCNCCDK8ROCK1HTT | |
| SCHEMBL3824090 | 0.84 | SELP (0.41) | RAF1CCNCCDK8ROCK1HTT | |
| SCHEMBL6608185 | 0.82 | RAF1 (0.43) | RAF1CCNCCDK8TEKALOX5 | |
| SCHEMBL3826599 | 0.79 | MEN1 (0.37) | RAF1CCNCCDK8TEKKDM4E | |
| SCHEMBL22579360 | 0.70 | MAOB (0.59) | HTTPORCNCYP3A4CYP2D6KDM4E | |
| SCHEMBL13780575 | 0.69 | MAPT (0.47) | HTTKDM4EMEN1KMT2A | |
| SCHEMBL3824754 | 0.69 | ALOX5 (0.41) | ALOX5KDM4EPOLBMEN1KMT2A | |
| SCHEMBL28869394 | 0.68 | MAOB (0.63) | HTTCYP3A4KDM4EPDE3BPDE3A | |
| SCHEMBL22579332 | 0.65 | ADH5 (0.59) | HTTCYP3A4KDM4EPDE3BPDE3A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0999835-B1 | IMIDAZOLE DERIVATIVES AS MDR MODULATORS | TAIJI BIOMEDICAL INC (US) | 2009-09-09 | — | — | EP | disclosed |
| EP-2082740-A2 | Use of imidazole derivatives as MDR modulators | Taiji Biomedical, Inc. (US) | 2009-07-29 | — | — | EP | disclosed |
| US-5840721-A | INCREASE SENSITIVITY OF MULTIDRUG RESISTANT TUMOR CELLS TO ANTICANCER AGENTS | ONTOGEN CORPORATION (US) | 1998-11-24 | — | — | US | disclosed |