Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 17/20 | 0.79 |
| ▸ | ESR2 | Q92731 | 17/20 | 0.79 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.67 |
| ▸ | ENPP3 | O14638 | 2/20 | 0.67 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | TP53 | P04637 | 2/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.62 |
| ▸ | MAPT | P10636 | 2/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.62 |
| ▸ | PLD2 | O14939 | 1/20 | 0.62 |
| ▸ | KDM1A | O60341 | 1/20 | 0.62 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.62 |
| ▸ | USP2 | O75604 | 1/20 | 0.62 |
| ▸ | C5 | P01031 | 1/20 | 0.62 |
| ▸ | FYN | P06241 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL7048820 | 0.90 | ESR1 (0.79) | ESR1ESR2ENPP1ENPP3MEN1 | |
| SCHEMBL6142049 | 0.89 | ESR1 (0.81) | ESR1ESR2ENPP1ENPP3MEN1 | |
| SCHEMBL1665661 | 0.89 | ESR1 (1.00) | ESR1ESR2ENPP1ENPP3MEN1 | |
| SCHEMBL6141712 | 0.88 | ESR1 (0.79) | ESR1ESR2ENPP1ENPP3MEN1 | |
| Hydrochloric Acid SCHEMBL2495864 | 0.88 | ESR1 (1.00) | ESR1ESR2ENPP1ENPP3MEN1 | |
| SCHEMBL7632970 | 0.88 | ESR1 (0.98) | ESR1ESR2ENPP1ENPP3MEN1 | |
| Bromide SCHEMBL1665326 | 0.88 | ESR1 (0.98) | ESR1ESR2ENPP1ENPP3MEN1 | |
| Hydrochloric Acid SCHEMBL1665332 | 0.88 | ESR1 (1.00) | ESR1ESR2ENPP1ENPP3MEN1 | |
| SCHEMBL6663935 | 0.88 | ESR1 (0.98) | ESR1ESR2ENPP1ENPP3MEN1 | |
| SCHEMBL7624666 | 0.87 | ESR1 (0.86) | ESR1ESR2ENPP1ENPP3MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0791590-B1 | Benzothiophenes, and formulations and methods using same | LILLY CO ELI (US) | 2003-05-02 | — | — | EP | disclosed |
| US-6432982-B1 | TREATING POST-MENOPAUSAL WOMEN HAVING OSTEOPOROSIS, CARDIOVASCULAR DISORDERS AND ESTROGEN-DEPENDENT CANCER; RESTENOSIS INHIBITION; ENDOMETRIOSIS | ELI LILLY AND COMPANY | 2002-08-13 | — | — | US | disclosed |
| EP-0791590-A1 | Benzothiophenes, and formulations and methods using same | ELI LILLY AND COMPANY (US) | 1997-08-27 | — | — | EP | disclosed |