Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 3/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.42 |
| ▸ | ITGAV | P06756 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7524496 | 0.82 | GABBR2 (0.46) | CTSAFFAR1MAPT | |
| SCHEMBL7216851 | 0.82 | HDAC4 (0.44) | CTSAITGB3ITGAVHDAC4HDAC7 | |
| SCHEMBL7517891 | 0.82 | CACNA2D1 (0.46) | CTSACES2FFAR1POLB | |
| SCHEMBL7522086 | 0.81 | FFAR1 (0.43) | CTSAHDAC4HDAC7HDAC5FFAR1 | |
| SCHEMBL5149908 | 0.77 | HDAC4 (0.51) | CTSAHDAC4HDAC7HDAC5CNR2 | |
| SCHEMBL5857867 | 0.76 | GABBR2 (0.50) | CTSAITGB3ITGAVHDAC4HDAC7 | |
| SCHEMBL7522581 | 0.76 | ALDH1A1 (0.43) | FFAR1CYP26A1 | |
| SCHEMBL7524713 | 0.75 | ITGB3 (0.46) | CTSAITGB3ITGAV | |
| SCHEMBL8770977 | 0.74 | CES2 (0.51) | CTSAHDAC4HDAC7HDAC5CNR2 | |
| SCHEMBL5514429 | 0.74 | HDAC4 (0.49) | HDAC4HDAC7HDAC5CNR2CES2 |
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-1181267-A1 | HALOGEN COMPOUNDS | Bayer Aktiengesellschaft (DE) | 2002-02-27 | — | — | EP | disclosed |
| WO-2000071500-A1 | HALOGEN COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 2000-11-30 | — | — | WO | disclosed |