Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.53 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.45 |
| ▸ | RELA | Q04206 | 2/20 | 0.45 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.45 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21184952 | 0.85 | ESR1 (0.48) | CA2SMN1; SMN2MEN1MAPTRAB9A | |
| SCHEMBL5682739 | 0.85 | APP (0.53) | APPHSP90AA1SMN1; SMN2MEN1MAPT | |
| SCHEMBL17167476 | 0.84 | APP (0.59) | APPSMN1; SMN2MEN1MAPTRAB9A | |
| SCHEMBL5743204 | 0.83 | MAPT (0.52) | APPHSP90AA1SMN1; SMN2MAPTRAB9A | |
| SCHEMBL31402836 | 0.82 | CYP1A1 (0.49) | SMN1; SMN2MEN1MAPTRAB9AKMT2A | |
| SCHEMBL21735627 | 0.81 | NFKB1 (0.45) | APPCA2SMN1; SMN2MEN1MAPT | |
| SCHEMBL21735571 | 0.81 | CA2 (0.46) | CA2SMN1; SMN2MAPTRAB9AMAPK1 | |
| SCHEMBL6832572 | 0.80 | ESR1 (0.58) | APPCA2SMN1; SMN2MEN1MAPT | |
| SCHEMBL5682883 | 0.79 | CYP1A1 (0.43) | CA2SMN1; SMN2MEN1MAPTRAB9A | |
| SCHEMBL226370 | 0.77 | CA2 (0.50) | APPCA2SMN1; SMN2MEN1MAPT |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0827959-B1 | Benzo[B]thiophene compounds, intermediates, processes, compositions, and methods | LILLY CO ELI (US) | 2003-12-03 | — | — | EP | disclosed |
| US-5977382-A | Benzo[b]thiophene compounds, intermediates, processes, compositions, and methods | ELI LILLY AND COMPANY (US) | 1999-11-02 | — | — | US | disclosed |
| US-5977098-A | Benzo[B]thiophene compounds, intermediates, processes, compositions, and methods | ELI LILLY AND COMPANY (US) | 1999-11-02 | — | — | US | disclosed |
| US-5952513-A | TREATING POSTMENOPAUSAL SYNDROME SUCH AS OSTEOPOROSIS | ELI LILLY AND COMPANY (US) | 1999-09-14 | — | — | US | disclosed |
| US-5843965-A | Benzo B! thiophene compounds, intermediates, processes, compositions, and methods | ELI LILLY AND COMPANY (US) | 1998-12-01 | — | — | US | disclosed |
| EP-0827959-A2 | Benzo[B]thiophene compounds, intermediates, processes, compositions, and methods | ELI LILLY AND COMPANY (US) | 1998-03-11 | — | — | EP | disclosed |
| US-5688796-A | TREATING OSTEOPOROSIS, CARDIOVASCULAR DISORDERS, ESTROGEN-DEPENDENT CANCER, ENDOMETRIOSIS, SMOOTH MUSCLE CELL PROLIFERATION, RESTENOSIS | ELI LILLY AND COMPANY (US) | 1997-11-18 | — | — | US | disclosed |
| EP-0801066-A1 | Heterocyclic substituted benzothiophenes and pharmaceutical compositions | ELI LILLY AND COMPANY (US) | 1997-10-15 | — | — | EP | disclosed |