Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 13/20 | 0.63 |
| ▸ | ESR2 | Q92731 | 13/20 | 0.63 |
| ▸ | ENPP3 | O14638 | 3/20 | 0.53 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.53 |
| ▸ | UBE2N | P61088 | 1/20 | 0.49 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | PLD2 | O14939 | 1/20 | 0.48 |
| ▸ | KDM1A | O60341 | 1/20 | 0.48 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | C5 | P01031 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | FYN | P06241 | 1/20 | 0.48 |
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL987943 | 0.88 | ESR1 (0.64) | ESR1ESR2UBE2NMEN1PLD2 | |
| Hydrochloric Acid SCHEMBL8866853 | 0.88 | ENPP3 (0.56) | ESR1ESR2ENPP3ENPP1UBE2N | |
| Hydrochloric Acid SCHEMBL3974968 | 0.87 | ESR1 (0.64) | ESR1ESR2UBE2NMEN1PLD2 | |
| SCHEMBL5409936 | 0.84 | TUBB4A (0.47) | ESR1ESR2ALDH1A1MAPTCNR1 | |
| SCHEMBL7942841 | 0.82 | ESR1 (0.52) | ESR1ESR2ENPP3ENPP1ITGA4 | |
| SCHEMBL7944330 | 0.82 | ESR1 (0.51) | ESR1ESR2ENPP3ENPP1ITGA4 | |
| SCHEMBL7944288 | 0.82 | ESR1 (0.51) | ESR1ESR2ENPP3ENPP1ITGA4 | |
| Hydrochloric Acid SCHEMBL7100412 | 0.82 | ESR1 (0.66) | ESR1ESR2ENPP3ENPP1UBE2N | |
| Hydrochloric Acid SCHEMBL7097572 | 0.81 | ESR1 (0.64) | ESR1ESR2ENPP3ENPP1UBE2N | |
| SCHEMBL6749914 | 0.81 | BCHE (0.58) | ESR1ESR2ALDH1A1MAPTACHE |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0979076-A4 | INTERMEDIATES AND PROCESSES FOR PREPARING BENZO b]THIOPHENES | LILLY CO ELI (US) | 2003-03-19 | — | — | EP | disclosed |
| EP-0979076-A1 | INTERMEDIATES AND PROCESSES FOR PREPARING BENZO b]THIOPHENES | ELI LILLY AND COMPANY (US) | 2000-02-16 | — | — | EP | disclosed |
| US-6018056-A | Intermediates and processes for preparing benzo (b) thiophenes | ELI LILLY AND COMPANY (US) | 2000-01-25 | — | — | US | disclosed |
| WO-1998048793-A1 | INTERMEDIATES AND PROCESSES FOR PREPARING BENZO[b]THIOPHENES | ELI LILLY AND COMPANY (US) | 1998-11-05 | — | — | WO | disclosed |