Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA2D1 | P54289 | 5/20 | 0.41 |
| ▸ | KHK | P50053 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.31 |
| ▸ | DRD4 | P21917 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5237215 | 0.91 | CACNA2D1 (0.36) | CACNA2D1KMT2ANPC1RAB9AMEN1 | |
| SCHEMBL5237036 | 0.89 | CACNA2D1 (0.42) | CACNA2D1OPRM1 | |
| SCHEMBL5235781 | 0.89 | ALDH1A1 (0.34) | CACNA2D1KMT2ANPC1RAB9AMEN1 | |
| SCHEMBL5236494 | 0.87 | GAA (0.35) | CACNA2D1UCHL1OPRM1 | |
| SCHEMBL5230826 | 0.86 | CACNA2D1 (0.42) | CACNA2D1KHKKMT2AMEN1KCNH2 | |
| SCHEMBL5230831 | 0.86 | CACNA2D1 (0.42) | CACNA2D1KHKKMT2AMEN1KCNH2 | |
| SCHEMBL5234101 | 0.85 | GAA (0.39) | CACNA2D1KMT2ANPC1RAB9AMEN1 | |
| SCHEMBL5238148 | 0.85 | POLB (0.40) | CACNA2D1OPRM1 | |
| SCHEMBL5233869 | 0.84 | OPRM1 (0.36) | CACNA2D1KMT2AOPRM1 | |
| SCHEMBL5231854 | 0.83 | NPSR1 (0.44) | CACNA2D1NPC1RAB9ADRD4 |
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-1730116-B1 | 4-CARBOX PYRAZOLE DERIVATES USEFUL AS ANTI-VIRAL AGENTS | SMITHKLINE BEECHAM CORP (US) | 2007-09-05 | — | — | EP | claimed |