Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.34 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.32 |
| ▸ | CTSD | P07339 | 2/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | CCR2 | P41597 | 1/20 | 0.31 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL5621238 | 1.00 | DRD2 (0.43) | DRD2DRD3KCNH2LMNASIRT2 | |
| SCHEMBL5621880 | 0.83 | DRD2 (0.48) | DRD2DRD3KCNH2LMNA | |
| SCHEMBL5621555 | 0.83 | DRD2 (0.48) | DRD2DRD3KCNH2LMNA | |
| SCHEMBL5622914 | 0.81 | SIGMAR1 (0.45) | DRD2DRD3KCNH2 | |
| SCHEMBL5622298 | 0.81 | DRD2 (0.46) | DRD2DRD3KCNH2LMNAADORA2A | |
| SCHEMBL5620557 | 0.80 | DRD2 (0.46) | DRD2DRD3KCNH2GRIN2BADORA2A | |
| SCHEMBL5622611 | 0.80 | DRD2 (0.46) | DRD2DRD3KCNH2GRIN2BADORA2A | |
| SCHEMBL14458480 | 0.80 | DRD2 (0.46) | DRD2DRD3KCNH2GRIN2BADORA2A | |
| SCHEMBL5622376 | 0.78 | DRD2 (0.46) | DRD2DRD3KCNH2ADORA2A | |
| SCHEMBL14458604 | 0.78 | DRD2 (0.46) | DRD2DRD3KCNH2ADORA2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1496897-A4 | TYROSINE KINASE INHIBITORS | MERCK & CO INC (US) | 2006-05-10 | — | — | EP | disclosed |
| EP-1496897-A1 | TYROSINE KINASE INHIBITORS | Merck & Co., Inc. (US) | 2005-01-19 | — | — | EP | disclosed |
| WO-2003086395-A1 | TYROSINE KINASE INHIBITORS | MERCK & CO., INC. (US) | 2003-10-23 | — | — | WO | disclosed |