Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 14/20 | 0.70 |
| ▸ | ESR2 | Q92731 | 14/20 | 0.70 |
| ▸ | ENPP3 | O14638 | 3/20 | 0.59 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.59 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.55 |
| ▸ | TUBB | P07437 | 1/20 | 0.55 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.55 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.55 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.55 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.55 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.55 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.55 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.55 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.55 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.55 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.55 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.55 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.55 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.55 |
| ▸ | CNR1 | P21554 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6979219 | 0.87 | ESR1 (0.70) | ESR1ESR2CNR1MEN1ALDH1A1 | |
| SCHEMBL6773068 | 0.87 | ESR1 (0.66) | ESR1ESR2ENPP3ENPP1TUBB4A | |
| Hydrochloric Acid SCHEMBL6767144 | 0.86 | ESR1 (0.67) | ESR1ESR2ENPP3ENPP1TUBB4A | |
| SCHEMBL7971668 | 0.86 | ESR1 (0.67) | ESR1ESR2ENPP3ENPP1TUBB4A | |
| SCHEMBL7970907 | 0.85 | ESR1 (0.73) | ESR1ESR2ENPP3ENPP1TUBB4A | |
| SCHEMBL6967393 | 0.84 | ESR1 (0.71) | ESR1ESR2ENPP3ENPP1TUBB4A | |
| SCHEMBL6980679 | 0.84 | ESR1 (0.71) | ESR1ESR2ENPP3ENPP1TUBB4A | |
| SCHEMBL1665661 | 0.83 | ESR1 (1.00) | ESR1ESR2ENPP3ENPP1CNR1 | |
| SCHEMBL23113126 | 0.83 | ESR1 (0.70) | ESR1ESR2ENPP3ENPP1TUBB4A | |
| SCHEMBL8519077 | 0.83 | ESR1 (0.70) | ESR1ESR2ENPP3ENPP1TUBB4A |
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-0832888-B1 | Benzothiophene compounds, compositions, and methods | LILLY CO ELI (US) | 2003-07-23 | — | — | EP | disclosed |
| US-5981570-A | INHIBITING BONE LOSS OR BONE RESORPTION, PARTICULARLY OSTEOPOROSIS, CARDIOVASCULAR-RELATED PATHOLOGICAL CONDITIONS, INCLUDING HYPERLIPIDEMIA. | ELI LILLY AND COMPANY (US) | 1999-11-09 | — | — | US | disclosed |