Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PSIP1 | O75475 | 2/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3121446 | 0.85 | MBOAT4 (0.45) | CNR2HTTPARP1CYP3A4CYP2C19 | |
| SCHEMBL16234260 | 0.79 | PSIP1 (0.39) | JAK1TYK2PARP1NPSR1MBOAT4 | |
| SCHEMBL25216536 | 0.79 | MAOB (0.34) | CNR2HTTCYP3A4CYP2C19PDE4B | |
| SCHEMBL3928945 | 0.77 | CNR2 (0.47) | CNR2JAK1TYK2PARP1NPSR1 | |
| SCHEMBL3466817 | 0.74 | CNR2 (0.37) | CNR2JAK1TYK2PARP1NPSR1 | |
| SCHEMBL29351319 | 0.74 | P2RX7 (0.49) | HTTPARP1NPSR1MBOAT4ALDH1A1 | |
| SCHEMBL6510299 | 0.74 | P2RX7 (0.49) | HTTPARP1NPSR1MBOAT4ALDH1A1 | |
| SCHEMBL3466471 | 0.74 | CNR2 (0.35) | CNR2JAK1TYK2PARP1NPSR1 | |
| SCHEMBL16232198 | 0.73 | PSIP1 (0.34) | CNR2HTTJAK1TYK2NPSR1 | |
| SCHEMBL3223183 | 0.72 | CPB2 (0.42) | HTTNPSR1HRH4GRIN2DGRIN3B |
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-2010036632-A1 | AZAINDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-04-01 | — | — | WO | disclosed |