Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.47 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.47 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.46 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | RBP4 | P02753 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21523707 | 0.93 | SMN1; SMN2 (0.52) | NTRK1SMN1; SMN2SCD5MAPTPOLB | |
| SCHEMBL25281540 | 0.88 | PDE4B (0.49) | PDE4BMAPTKDM4ETHRB | |
| SCHEMBL30464770 | 0.88 | PDE4B (0.49) | PDE4BMAPTKDM4ETHRB | |
| SCHEMBL19404908 | 0.86 | SMN1; SMN2 (0.54) | SMN1; SMN2PDE4BBRD3MAPTPOLB | |
| SCHEMBL25320988 | 0.81 | USP30 (0.55) | SMN1; SMN2PDE4BMAPTKDM4ETHRB | |
| SCHEMBL22059962 | 0.81 | KDM4E (0.46) | NTRK1SMN1; SMN2KDM4EHDAC1HDAC2 | |
| SCHEMBL30700671 | 0.81 | KDM4E (0.46) | NTRK1SMN1; SMN2KDM4EHDAC1HDAC2 | |
| SCHEMBL1827361 | 0.80 | PDE4B (0.58) | SMN1; SMN2PDE4BMAPTPOLBKDM4E | |
| SCHEMBL1828228 | 0.80 | PDE4B (0.58) | SMN1; SMN2PDE4BMAPTPOLBKDM4E | |
| SCHEMBL1827362 | 0.80 | PDE4B (0.58) | SMN1; SMN2PDE4BMAPTPOLBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1515724-B1 | MITOTIC KINESIN INHIBITORS | MERCK & CO INC (US) | 2009-10-21 | — | — | EP | disclosed |