Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.51 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.51 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.51 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.51 |
| ▸ | P2RX7 | Q99572 | 11/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | SYK | P43405 | 1/20 | 0.46 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2228519 | 1.00 | PDK1 (0.51) | PDK1PDK2PDK3PDK4P2RX7 | |
| SCHEMBL2228517 | 1.00 | PDK1 (0.51) | PDK1PDK2PDK3PDK4P2RX7 | |
| SCHEMBL2229274 | 0.83 | SYK (0.45) | P2RX7SYKCTSL | |
| SCHEMBL2229278 | 0.83 | SYK (0.45) | P2RX7SYKCTSL | |
| SCHEMBL29300886 | 0.83 | PDK1 (0.70) | PDK1PDK2PDK3PDK4PARP1 | |
| SCHEMBL953545 | 0.83 | PDK1 (0.70) | PDK1PDK2PDK3PDK4PARP1 | |
| SCHEMBL952361 | 0.83 | PDK1 (0.70) | PDK1PDK2PDK3PDK4PARP1 | |
| SCHEMBL1931615 | 0.82 | ABCB1 (0.46) | P2RX7SYKCTSL | |
| SCHEMBL13994302 | 0.82 | PDK1 (0.56) | PDK1PDK2PDK3PDK4BACE1 | |
| SCHEMBL8117814 | 0.81 | PDK1 (0.67) | PDK1PDK2PDK3PDK4PARP1 |
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-2011091410-A1 | TRPV4 ANTAGONISTS | GLAXOS SMITHKLINE LLC (US) | 2011-07-28 | — | — | WO | disclosed |