Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.37 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3704495 | 0.79 | OPRM1 (0.52) | RAB9ANPC1MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL6226205 | 0.76 | CARM1 (0.38) | SMN1; SMN2LMNAPOLBSLC6A2SLC6A4 | |
| SCHEMBL6225822 | 0.72 | RAB9A (0.42) | RAB9ANPC1MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL3886739 | 0.70 | OPRM1 (0.52) | RAB9ANPC1MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL3690894 | 0.68 | OPRK1 (0.53) | RAB9ANPC1MAPTALDH1A1LMNA | |
| SCHEMBL13285437 | 0.67 | OPRM1 (0.53) | RAB9ANPC1MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL13773062 | 0.67 | OPRM1 (0.55) | MAPTALDH1A1POLBCYP1A2CYP3A4 | |
| SCHEMBL4963842 | 0.66 | OPRM1 (0.48) | RAB9ANPC1MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL27569145 | 0.64 | OPRM1 (0.55) | RAB9ANPC1MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL5581293 | 0.64 | RXRA (0.50) | RAB9ANPC1POLBCYP1A2KMT2A |
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-1562595-A1 | DIARYL ETHERS AS OPIOID RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 2005-08-17 | — | — | EP | disclosed |
| WO-2004026305-A1 | DIARYL ETHERS AS OPIOID RECEPTOR ANTAGONIST | ELI LILLY AND COMPANY (US) | 2004-04-01 | — | — | WO | disclosed |