Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 6/20 | 0.31 |
| ▸ | JAK1 | P23458 | 6/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | MRGPRX2 | Q96LB1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL878508 | 0.90 | F10 (0.34) | F10ADORA2AADORA1JAK2JAK1 | |
| SCHEMBL876131 | 0.86 | POLB (0.34) | F10JAK2JAK1POLB | |
| SCHEMBL875758 | 0.84 | F10 (0.34) | F10JAK2JAK1POLB | |
| SCHEMBL878405 | 0.82 | TLR9 (0.37) | TLR9TLR8TLR7F10ADORA2A | |
| SCHEMBL878327 | 0.79 | TLR9 (0.36) | TLR9TLR8TLR7F10ADORA2A | |
| SCHEMBL876268 | 0.78 | F10 (0.34) | F10POLB | |
| SCHEMBL878326 | 0.77 | TLR9 (0.39) | TLR9TLR8TLR7F10ADORA2A | |
| SCHEMBL785591 | 0.77 | F10 (0.44) | TLR9TLR8TLR7F10ADORA2A | |
| SCHEMBL784885 | 0.75 | TLR9 (0.42) | TLR9TLR8TLR7F10ADORA2A | |
| SCHEMBL784539 | 0.75 | TLR9 (0.43) | TLR9TLR8TLR7F10ADORA2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2619178-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2013-07-31 | — | — | EP | claimed |
| WO-2012038081-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2012-03-29 | — | — | WO | claimed |
| EP-2619178-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2013-07-31 | — | — | EP | disclosed |
| WO-2012038081-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2012-03-29 | — | — | WO | disclosed |