Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 2/20 | 0.38 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.35 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.35 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 3/20 | 0.32 |
| ▸ | ITGA4 | P13612 | 3/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4661488 | 0.89 | HTT (0.40) | HTTALDH1A1 | |
| SCHEMBL4661449 | 0.87 | CDK4 (0.38) | CDK4CDK2HTTKDM4EALDH1A1 | |
| SCHEMBL4661583 | 0.87 | CDK4 (0.38) | CDK4CDK2HTTKDM4EALDH1A1 | |
| SCHEMBL4661500 | 0.86 | ALDH1A1 (0.41) | HTTLIMK2KDM4EALDH1A1 | |
| SCHEMBL4661323 | 0.86 | ALDH1A1 (0.41) | HTTLIMK2KDM4EALDH1A1 | |
| SCHEMBL4661434 | 0.82 | CDK4 (0.40) | CDK4CDK2KDM4E | |
| SCHEMBL4661305 | 0.76 | PYCR1 (0.42) | HTTKDM4EALDH1A1 | |
| SCHEMBL4661399 | 0.76 | PYCR1 (0.42) | HTTKDM4EALDH1A1 | |
| SCHEMBL4346610 | 0.74 | KDM4E (0.55) | CDK4CDK2MAPK13MAPK12MAPK11 | |
| SCHEMBL4661242 | 0.73 | POLB (0.45) | CDK4CDK2HTTKDM4E |
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-2007707-A1 | COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR | Boehringer Ingelheim International GmbH (DE) | 2008-12-31 | — | — | EP | disclosed |
| WO-2007118041-A1 | COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-10-18 | — | — | WO | disclosed |