Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | NPY2R | P49146 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | BMP1 | P13497 | 1/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4563434 | 0.94 | P2RX7 (0.36) | CYP1A2CYP2C9CYP2C19RAB9AL3MBTL1 | |
| SCHEMBL4562546 | 0.91 | CYP2C9 (0.43) | CYP1A2CYP2C9CYP2C19ALOX5RAB9A | |
| SCHEMBL7579993 | 0.87 | P2RX7 (0.32) | P2RX7 | |
| SCHEMBL3869878 | 0.81 | CYP1A2 (0.41) | CYP1A2CYP2C9CYP2C19ALOX5RAB9A | |
| SCHEMBL3859251 | 0.79 | P2RX7 (0.38) | CYP1A2CYP2C9CYP2C19L3MBTL1P2RX7 | |
| SCHEMBL5655126 | 0.79 | CYP2C9 (0.39) | CYP1A2CYP2C9CYP2C19ALOX5RAB9A | |
| SCHEMBL3850655 | 0.78 | P2RX7 (0.40) | L3MBTL1P2RX7MEN1KMT2AALDH1A1 | |
| SCHEMBL4564688 | 0.77 | BMP1 (0.30) | BMP1 | |
| SCHEMBL4563644 | 0.77 | PTGES (0.35) | ALOX5P2RX7KMT2AALDH1A1 | |
| SCHEMBL4563287 | 0.76 | RORC (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1635822-A4 | METHODS AND COMPOSITIONS FOR TREATING RHEUMATOID ARTHRITIS | ELAN PHARM INC (US) | 2009-06-24 | — | — | EP | disclosed |
| EP-1635822-A2 | METHODS AND COMPOSITIONS FOR TREATING RHEUMATOID ARTHRITIS | Elan Pharmaceuticals, Inc. (US) | 2006-03-22 | — | — | EP | disclosed |
| WO-2005000246-A2 | METHODS AND COMPOSITIONS FOR TREATING RHEUMATOID ARTHRITIS | ELAN PHARMACEUTICALS, INC. (US) | 2005-01-06 | — | — | WO | disclosed |