Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 9/20 | 0.56 |
| ▸ | DRD3 | P35462 | 2/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 3/20 | 0.43 |
| ▸ | MAOB | P27338 | 3/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL803477 | 0.90 | ACHE (0.58) | ACHEMAOAMAOBBCHE | |
| SCHEMBL27920400 | 0.90 | ACHE (0.58) | ACHEMAOAMAOBBCHE | |
| SCHEMBL2461644 | 0.86 | DRD3 (0.50) | ACHEDRD3CA12CA1CA2 | |
| SCHEMBL784661 | 0.84 | ACHE (0.57) | ACHEDRD3MAOAMAOBBCHE | |
| SCHEMBL31337581 | 0.81 | DRD3 (0.46) | ACHEDRD3CA12CA1CA2 | |
| SCHEMBL30583552 | 0.81 | DRD3 (0.46) | ACHEDRD3CA12CA1CA2 | |
| SCHEMBL876503 | 0.80 | DRD3 (0.54) | ACHEDRD3CA12CA1CA2 | |
| SCHEMBL30583242 | 0.80 | DRD3 (0.54) | ACHEDRD3CA12CA1CA2 | |
| SCHEMBL785601 | 0.77 | MEN1 (0.46) | ACHEMAOAMAOBBCHE | |
| SCHEMBL785602 | 0.77 | MEN1 (0.46) | ACHEMAOAMAOBBCHE |
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-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 |