Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.52 |
| ▸ | ABHD6 | Q9BV23 | 9/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | TRAP1 | Q12931 | 3/20 | 0.43 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.42 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.42 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | HSP90B1 | P14625 | 2/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23553488 | 1.00 | ESR1 (0.52) | ESR1ESR2ABHD6NPC1RAB9A | |
| SCHEMBL8177222 | 0.85 | ESR1 (0.56) | ESR1ESR2ABHD6 | |
| SCHEMBL772680 | 0.84 | ABHD6 (0.69) | ESR1ESR2ABHD6TRAP1 | |
| SCHEMBL7402991 | 0.84 | ESR1 (0.51) | ESR1ESR2ABHD6NPC1RAB9A | |
| SCHEMBL7641094 | 0.84 | ABHD6 (0.52) | ESR1ESR2ABHD6NOTUM | |
| SCHEMBL30924716 | 0.83 | NPC1 (0.47) | ABHD6NPC1RAB9ATRAP1DPP8 | |
| SCHEMBL7637893 | 0.82 | ESR1 (0.56) | ESR1ESR2ABHD6 | |
| SCHEMBL772912 | 0.82 | ESR1 (0.49) | ESR1ESR2ABHD6NOTUM | |
| SCHEMBL7638156 | 0.82 | ABHD6 (0.50) | ESR1ESR2ABHD6NOTUM | |
| SCHEMBL25604256 | 0.81 | ABHD6 (0.57) | ESR1ESR2ABHD6NOTUM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024046221-A1 | EGFR INHIBITORS AND USES THEREOF | DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) | 2024-03-07 | — | — | WO | disclosed |