Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.52 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.52 |
| ▸ | ESR1 | P03372 | 2/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.50 |
| ▸ | STAT6 | P42226 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | THPO | P40225 | 1/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 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 | |
|---|---|---|---|---|
| SCHEMBL7410353 | 0.85 | ERCC1 (0.68) | L3MBTL1ERCC1ERCC4GFERPOLB | |
| SCHEMBL19842170 | 0.80 | CNR1 (0.61) | ERCC1ERCC4KMT2AMAPTTP53 | |
| Hydrochloric Acid SCHEMBL5310916 | 0.79 | L3MBTL1 (0.56) | L3MBTL1ERCC1ERCC4GFERPOLB | |
| SCHEMBL172708 | 0.79 | ESR1 (0.61) | ESR1ESR2ALOX15TP53ADRB2 | |
| SCHEMBL12305680 | 0.78 | MAPT (0.72) | ESR1ESR2GFERPOLBMAPT | |
| SCHEMBL11276210 | 0.77 | L3MBTL1 (0.53) | L3MBTL1ERCC1ERCC4GFERPOLB | |
| SCHEMBL6184638 | 0.77 | MAPT (0.58) | ERCC1ERCC4ESR1ESR2GFER | |
| SCHEMBL10055000 | 0.76 | L3MBTL1 (0.86) | L3MBTL1MAPTCYP1A2TSHRNFKB1 | |
| SCHEMBL1924746 | 0.76 | ESR1 (0.74) | ESR1ESR2MAPTMAPK1ALOX15 | |
| SCHEMBL29720481 | 0.76 | ESR1 (0.74) | ESR1ESR2MAPTMAPK1ALOX15 |
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 |