Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 9/20 | 0.35 |
| ▸ | ESR1 | P03372 | 8/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
| ▸ | TUBB | P07437 | 1/20 | 0.33 |
| ▸ | YES1 | P07947 | 1/20 | 0.33 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.33 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.33 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.33 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.33 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.33 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.33 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.33 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.33 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.33 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6605596 | 0.84 | CYP19A1 (0.35) | ESR2ESR1TUBB4ATUBBYES1 | |
| SCHEMBL6607888 | 0.79 | MAOB (0.48) | ESR2ESR1 | |
| SCHEMBL31607964 | 0.79 | CYP19A1 (0.50) | ESR2ESR1TUBB4ATUBBYES1 | |
| SCHEMBL6602817 | 0.76 | ALOX12 (0.53) | ESR2ESR1TUBB4ATUBBYES1 | |
| SCHEMBL6602578 | 0.75 | CYP1A1 (0.52) | CYP19A1NPC1CYP3A4ADORA3MAPT | |
| SCHEMBL6603263 | 0.75 | SLC6A2 (0.39) | ESR2ESR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6609372 | 0.74 | ADORA3 (0.42) | CYP19A1NPC1CYP3A4ADORA3MAPT | |
| SCHEMBL6603604 | 0.72 | CYP19A1 (0.35) | ESR2ESR1TUBB4ATUBBYES1 | |
| SCHEMBL12673928 | 0.72 | KDM4E (0.55) | ESR2ESR1CYP19A1CYP3A4MAPT | |
| SCHEMBL19941843 | 0.70 | TSHR (0.45) | SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0729464-A1 | 5,6-DIHYDROPYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS | PARKE, DAVIS & COMPANY (US) | 1996-09-04 | — | — | EP | disclosed |