Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 2/20 | 0.67 |
| ▸ | CNR2 | P34972 | 2/20 | 0.67 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.62 |
| ▸ | ESR1 | P03372 | 12/20 | 0.62 |
| ▸ | ESR2 | Q92731 | 12/20 | 0.62 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.57 |
| ▸ | NAPEPLD | Q6IQ20 | 1/20 | 0.57 |
| ▸ | F2 | P00734 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.50 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11547037 | 0.97 | CNR1 (0.62) | CNR1CNR2PAX8ESR1ESR2 | |
| SCHEMBL11545740 | 0.96 | ESR1 (0.67) | CNR1CNR2PAX8ESR1ESR2 | |
| SCHEMBL4652009 | 0.96 | CNR2 (0.75) | CNR1CNR2PAX8ESR1ESR2 | |
| SCHEMBL4651840 | 0.96 | ESR1 (0.67) | CNR1CNR2PAX8ESR1ESR2 | |
| SCHEMBL8733651 | 0.89 | CNR2 (0.66) | CNR1CNR2PAX8ESR1ESR2 | |
| SCHEMBL6595454 | 0.89 | ESR1 (0.80) | CNR1ESR1ESR2F2TDP1 | |
| SCHEMBL11548759 | 0.87 | ESR1 (0.66) | CNR1CNR2PAX8ESR1ESR2 | |
| SCHEMBL11555273 | 0.87 | ESR1 (0.66) | CNR1ESR1ESR2TDP1 | |
| SCHEMBL8596134 | 0.86 | ESR1 (0.60) | CNR1CNR2PAX8ESR1ESR2 | |
| SCHEMBL11546663 | 0.86 | ESR1 (0.62) | CNR1ESR1ESR2TDP1 |
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 |