Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19005681 | 0.74 | DRD3 (0.33) | DRD3KCNQ2FAAH | |
| SCHEMBL8030062 | 0.74 | MAOA (0.43) | DRD3KCNQ2FAAH | |
| SCHEMBL6369683 | 0.69 | DRD3 (0.41) | DRD3KCNQ2 | |
| SCHEMBL1438685 | 0.64 | — | — | |
| SCHEMBL19820931 | 0.63 | DRD1 (0.50) | DRD3 | |
| SCHEMBL13932188 | 0.62 | — | — | |
| SCHEMBL3022168 | 0.62 | ALDH1A1 (0.35) | DRD3 | |
| SCHEMBL31555255 | 0.60 | AVPR1A (0.35) | KCNQ2 | |
| SCHEMBL302485 | 0.59 | MAOA (0.58) | DRD3 | |
| SCHEMBL29603392 | 0.59 | MAOA (0.58) | DRD3 |
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-2251338-A2 | Organic compounds | Boehringer Ingelheim International GmbH (DE) | 2010-11-17 | — | — | EP | disclosed |
| WO-2009065919-A2 | NOVEL COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-05-28 | — | — | WO | disclosed |