Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 12/20 | 0.58 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.58 |
| ▸ | ESRRG | P62508 | 7/20 | 0.47 |
| ▸ | ESRRB | O95718 | 3/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.41 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.40 |
| ▸ | ESRRA | P11474 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7531753 | 0.86 | ESR1 (0.46) | ESR1ESR2ESRRGESRRBKCNH2 | |
| SCHEMBL7525989 | 0.85 | ESR1 (0.78) | ESR1ESR2KCNH2HRH3CHRM3 | |
| SCHEMBL7531774 | 0.84 | ESR1 (0.80) | ESR1ESR2KCNH2HRH3CHRM3 | |
| SCHEMBL7529441 | 0.83 | ESR1 (0.49) | ESR1ESR2ESRRGCHRNB4CHRNA3 | |
| SCHEMBL7528581 | 0.80 | ESR1 (0.41) | ESR1ESR2ESRRGESRRBKCNH2 | |
| SCHEMBL7138229 | 0.78 | ESR1 (0.45) | ESR1ESR2ESRRGESRRBKCNH2 | |
| SCHEMBL8966130 | 0.78 | ESR1 (0.86) | ESR1ESR2 | |
| SCHEMBL7525411 | 0.77 | ESR1 (0.85) | ESR1ESR2 | |
| SCHEMBL7524102 | 0.77 | ESR1 (0.87) | ESR1ESR2 | |
| SCHEMBL7533378 | 0.76 | ESR1 (0.65) | ESR1ESR2KCNH2HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| US-20020165084-A1 | Metallocene compositions | EXXONMOBIL CHEMICAL PATENTS INC. | 2002-11-07 | — | — | US | disclosed |
| EP-0832881-B1 | Benzofluorene compounds, intermediates, compositions, and methods | LILLY CO ELI (US) | 2002-04-03 | — | — | EP | disclosed |
| EP-0832881-A2 | Benzofluorene compounds, intermediates, compositions, and methods | ELI LILLY AND COMPANY (US) | 1998-04-01 | — | — | EP | disclosed |