Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPID | Q08752 | 3/20 | 0.46 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.40 |
| ▸ | ITGAV | P06756 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.38 |
| ▸ | PPIB | P23284 | 1/20 | 0.38 |
| ▸ | PPIA | P62937 | 1/20 | 0.38 |
| ▸ | PPIG | Q13427 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3127052 | 0.80 | TACR1 (0.51) | ITGB3ITGAVPOLBTACR1 | |
| SCHEMBL2982541 | 0.78 | CTSS (0.50) | PPIDITGB3TACR1CYP1A2GAA | |
| SCHEMBL13913373 | 0.78 | CTSS (0.50) | PPIDITGB3TACR1CYP1A2GAA | |
| SCHEMBL1620166 | 0.78 | CTSS (0.50) | PPIDITGB3TACR1CYP1A2GAA | |
| SCHEMBL6528368 | 0.77 | HDAC3 (0.35) | ITGB3ITGAVCYP1A2CYP3A4 | |
| SCHEMBL16054277 | 0.77 | LNPEP (0.49) | PPIDPOLBPPIBPPIAPPIG | |
| SCHEMBL16054276 | 0.77 | LNPEP (0.49) | PPIDPOLBPPIBPPIAPPIG | |
| SCHEMBL30142880 | 0.77 | PPID (0.53) | PPIDPOLBPPIBPPIAPPIG | |
| SCHEMBL5117148 | 0.77 | PPID (0.50) | PPIDPOLBPPIBPPIAPPIG | |
| SCHEMBL31256909 | 0.74 | PPID (0.50) | PPIDPOLBHPRT1PPIBPPIA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1525204-A1 | PHENYLALANINE ENAMIDE DERIVATIVES | Celltech R & D Limited (GB) | 2005-04-27 | — | — | EP | disclosed |
| WO-2004007494-A1 | PHENYLALANINE ENAMIDE DERIVATIVES | CELLTECH R & D LIMITED (GB) | 2004-01-22 | — | — | WO | disclosed |
| EP-1332132-A2 | ENAMINE DERIVATIVES AS CELL ADHESION MOLECULES | Celltech R&D Limited (GB) | 2003-08-06 | — | — | EP | disclosed |
| WO-2001079173-A2 | ENAMINE DERIVATIVES AS CELL ADHESION MOLECULES | CELLTECH R & D LIMITED (GB) | 2001-10-25 | — | — | WO | disclosed |