Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.47 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.45 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.44 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
| ▸ | RXRB | P28702 | 1/20 | 0.42 |
| ▸ | RXRG | P48443 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3973587 | 0.96 | MKNK1 (0.48) | MKNK1MKNK2EGFRLMNACYP11B1 | |
| SCHEMBL3972289 | 0.88 | MKNK1 (0.46) | MKNK1MKNK2EGFRLMNACYP11B1 | |
| SCHEMBL3974889 | 0.86 | MKNK1 (0.47) | MKNK1MKNK2EGFRLMNACYP11B1 | |
| SCHEMBL9306503 | 0.85 | THRA (0.56) | MKNK1MKNK2LMNAPDE4APDE4B | |
| SCHEMBL5227439 | 0.82 | RXRA (0.59) | CYP11B1CYP11B2PARP10KDM4ERXRA | |
| SCHEMBL3975202 | 0.80 | PARP10 (0.42) | MKNK1MKNK2PDE4DPARP10L3MBTL1 | |
| SCHEMBL31696706 | 0.79 | EGFR (0.53) | EGFRLMNACYP11B1CYP11B2PDE4A | |
| SCHEMBL2967356 | 0.78 | MKNK1 (0.72) | MKNK1MKNK2EGFRLMNAPDE4A | |
| Methane SCHEMBL21358430 | 0.77 | MKNK1 (0.70) | MKNK1MKNK2EGFRLMNAPDE4A | |
| SCHEMBL8747413 | 0.76 | EGFR (0.64) | EGFRCYP11B1CYP11B2PDE4APDE4B |
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-2054383-A2 | NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS | SmithKline Beecham Corporation (US) | 2009-05-06 | — | — | EP | disclosed |
| WO-2008021849-A2 | NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-02-21 | — | — | WO | disclosed |