Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 18/20 | 0.60 |
| ▸ | ESR2 | Q92731 | 11/20 | 0.56 |
| ▸ | CNR1 | P21554 | 1/20 | 0.51 |
| ▸ | CNR2 | P34972 | 1/20 | 0.51 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11546507 | 0.95 | ESR1 (0.58) | ESR1ESR2CNR1CNR2 | |
| SCHEMBL11547336 | 0.93 | ESR1 (0.61) | ESR1ESR2CNR1CNR2 | |
| SCHEMBL11548154 | 0.92 | ESR1 (0.56) | ESR1ESR2CNR1CNR2ENPP3 | |
| SCHEMBL11548534 | 0.92 | ESR1 (0.57) | ESR1ESR2CNR1CNR2ENPP3 | |
| SCHEMBL11547894 | 0.91 | ESR1 (0.73) | ESR1ESR2CNR1 | |
| SCHEMBL11550688 | 0.87 | CNR1 (0.57) | ESR1ESR2CNR1CNR2ENPP3 | |
| SCHEMBL11549669 | 0.86 | CNR2 (0.63) | ESR1ESR2CNR1CNR2 | |
| SCHEMBL11549535 | 0.85 | ESR1 (0.78) | ESR1ESR2CNR1ENPP3 | |
| SCHEMBL6973749 | 0.85 | ESR1 (0.68) | ESR1ESR2CNR1CNR2ENPP3 | |
| SCHEMBL11552308 | 0.85 | ESR1 (0.60) | ESR1ESR2ENPP3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4133814-A | ANTITUMOR AGENTS | ELI LILLY AND COMPANY (US) | 1979-01-09 | — | — | US | disclosed |