Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.51 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.51 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.51 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.51 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.50 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.50 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.50 |
| ▸ | KDM1A | O60341 | 2/20 | 0.49 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | DRD2 | P14416 | 2/20 | 0.48 |
| ▸ | DRD3 | P35462 | 2/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL31119841 | 0.90 | SOS1 (0.52) | SOS1GNAI3GNAO1GNAI1DRD2 | |
| SCHEMBL12329231 | 0.79 | SOS1 (0.43) | SOS1DRD2DRD3EPHX2 | |
| SCHEMBL12420662 | 0.77 | MTNR1A (0.56) | GNAI3GNAO1GNAI1 | |
| SCHEMBL4034002 | 0.73 | CYP2C19 (0.60) | EPHX2 | |
| SCHEMBL12913677 | 0.73 | KDM1A (0.70) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL12913969 | 0.72 | KDM1A (0.73) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL10045156 | 0.72 | KCNH2 (0.72) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL10045174 | 0.72 | KCNH2 (0.72) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL12913676 | 0.71 | KDM1A (0.68) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL16260026 | 0.71 | SMN1; SMN2 (0.47) | GNAI3GNAO1GNAI1EPHX2 |
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-2366698-A1 | Derivatives of urea and related diamines, methods for their manufacture, and uses therefor | Galapagos SAS (FR) | 2011-09-21 | — | — | EP | disclosed |