Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B13 | Q7Z5P4 | 2/20 | 0.40 |
| ▸ | KCNN3 | Q9UGI6 | 1/20 | 0.38 |
| ▸ | ACLY | P53396 | 1/20 | 0.37 |
| ▸ | CETP | P11597 | 2/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | FEN1 | P39748 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | AMPD2 | Q01433 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1114292 | 0.88 | MEP1B (0.36) | CETPROCK2P2RX7 | |
| SCHEMBL1114224 | 0.84 | KDM4E (0.41) | HSD17B13P2RX7 | |
| SCHEMBL1114208 | 0.79 | KDM4E (0.36) | — | |
| SCHEMBL4516945 | 0.73 | HSD17B13 (0.42) | HSD17B13KCNN3FEN1KCNN4P2RX7 | |
| SCHEMBL1114748 | 0.69 | HSD17B13 (0.40) | HSD17B13KCNN3CETPDRD4FEN1 | |
| SCHEMBL3240176 | 0.67 | RXRA (0.43) | FEN1ROCK2ROCK1GRIN2BP2RX7 | |
| SCHEMBL4504413 | 0.66 | FEN1 (0.39) | HSD17B13CETPDRD4FEN1KCNN4 | |
| SCHEMBL1114303 | 0.65 | MEP1B (0.36) | CETPROCK2P2RX7 | |
| SCHEMBL690748 | 0.65 | ROCK2 (0.52) | ROCK2ROCK1 | |
| SCHEMBL28160866 | 0.63 | KCNN3 (0.46) | KCNN3DRD4ROCK2ROCK1KCNN4 |
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-2278879-A2 | COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING OXADIAZOLE DERIVATIVES | Institute for OneWorld Health (US) | 2011-02-02 | — | — | EP | claimed |
| WO-2009131957-A2 | COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING OXADIAZOLE DERIVATIVES | INSTITUTE FOR ONEWORLD HEALTH (US) | 2009-10-29 | — | — | WO | claimed |