Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 2/20 | 0.51 |
| ▸ | DRD2 | P14416 | 10/20 | 0.49 |
| ▸ | DRD4 | P21917 | 10/20 | 0.49 |
| ▸ | HTR1A | P08908 | 9/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.43 |
| ▸ | KDM5A | P29375 | 1/20 | 0.42 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.41 |
| ▸ | HTR3B | O95264 | 1/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.41 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | CCR8 | P51685 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17888476 | 0.84 | DRD2 (0.53) | MAP4K4DRD2DRD4HTR1AKCNH2 | |
| SCHEMBL1610517 | 0.83 | CCR1 (0.52) | MAP4K4DRD2DRD4HTR1AKCNH2 | |
| SCHEMBL17886956 | 0.80 | DRD2 (0.53) | MAP4K4DRD2DRD4HTR1AKCNH2 | |
| SCHEMBL17896362 | 0.80 | DRD2 (0.47) | MAP4K4DRD2DRD4HTR1AKCNH2 | |
| SCHEMBL15087991 | 0.80 | CCR1 (0.48) | MAP4K4DRD2DRD4HTR1AKCNH2 | |
| SCHEMBL2757250 | 0.80 | CCR1 (0.48) | MAP4K4DRD2DRD4HTR1AKCNH2 | |
| SCHEMBL8056158 | 0.78 | DRD2 (0.50) | MAP4K4DRD2DRD4HTR1AKCNH2 | |
| SCHEMBL20139993 | 0.78 | DRD2 (0.54) | MAP4K4DRD2DRD4HTR1AKCNH2 | |
| SCHEMBL18129069 | 0.77 | MAP4K4 (0.56) | MAP4K4 | |
| SCHEMBL21661933 | 0.76 | DRD2 (0.59) | MAP4K4DRD2DRD4HTR1AKCNH2 |
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-2012169934-A1 | NOVEL KINASE INHIBITORS | ОБЩЕСТВО С ОГРАНИЧЕННОЙ ОТВЕТСТВЕННОСТЬЮ "АСИНЭКС МЕДХИМ" (RU) | 2012-12-13 | — | — | WO | disclosed |