Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | FDPS | P14324 | 1/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 7/20 | 0.46 |
| ▸ | ITGAV | P06756 | 7/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2360199 | 0.79 | SMN1; SMN2 (0.56) | CYP2D6GAAALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL4394126 | 0.78 | ITGB3 (0.64) | ITGB3ITGAVGAAHDAC3HDAC4 | |
| SCHEMBL5524161 | 0.78 | CYP2D6 (0.52) | CYP2D6FDPSITGB3ITGAVGAA | |
| SCHEMBL15208481 | 0.77 | CYP2D6 (0.58) | CYP2D6FDPSITGB3ITGAVGAA | |
| SCHEMBL13884957 | 0.77 | CYP2D6 (0.50) | CYP2D6FDPSGAAALDH1A1SMN1; SMN2 | |
| SCHEMBL30919995 | 0.77 | CYP2D6 (0.58) | CYP2D6FDPSITGB3ITGAVGAA | |
| SCHEMBL2037116 | 0.77 | ITGB3 (0.70) | ITGB3ITGAVHDAC3HDAC4HDAC1 | |
| SCHEMBL17234281 | 0.77 | CYP2D6 (0.58) | CYP2D6FDPSITGB3ITGAVGAA | |
| SCHEMBL15208486 | 0.77 | CYP2D6 (0.58) | CYP2D6FDPSITGB3ITGAVGAA | |
| SCHEMBL30919988 | 0.77 | CYP2D6 (0.58) | CYP2D6FDPSITGB3ITGAVGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011095218-A1 | TEMPLATE-FIXED PEP TIDOMIME TICS WITH CXCR7 MODULATING ACTIVITY | POLYPHOR AG (CH) | 2011-08-11 | — | — | WO | disclosed |