Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 9/20 | 0.60 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.52 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6963682 | 1.00 | CYP19A1 (0.60) | CYP19A1TBXAS1CYP11B1CYP11B2MEN1 | |
| SCHEMBL6954397 | 0.85 | TBXAS1 (0.56) | CYP19A1TBXAS1CYP11B1CYP11B2 | |
| SCHEMBL6954390 | 0.85 | TBXAS1 (0.56) | CYP19A1TBXAS1CYP11B1CYP11B2 | |
| SCHEMBL11078035 | 0.83 | TUBB1 (0.58) | TBXAS1TUBB1ALDH1A1 | |
| SCHEMBL11078037 | 0.83 | TUBB1 (0.58) | TBXAS1TUBB1ALDH1A1 | |
| SCHEMBL11390231 | 0.82 | TBXAS1 (0.53) | CYP19A1TBXAS1CYP11B1MEN1KMT2A | |
| SCHEMBL11080822 | 0.78 | TBXAS1 (0.57) | CYP19A1TBXAS1CYP11B1CYP11B2MEN1 | |
| SCHEMBL11080818 | 0.78 | TBXAS1 (0.57) | CYP19A1TBXAS1CYP11B1CYP11B2MEN1 | |
| SCHEMBL6956351 | 0.76 | CYP19A1 (0.56) | CYP19A1TBXAS1CYP11B1CYP11B2MEN1 | |
| SCHEMBL6956348 | 0.76 | CYP19A1 (0.56) | CYP19A1TBXAS1CYP11B1CYP11B2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0974584-B1 | FUSED RING COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-01-15 | — | — | EP | disclosed |
| US-6420375-B1 | ANTITUMOR | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2002-07-16 | — | — | US | disclosed |
| EP-0974584-A1 | FUSED RING COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF | Takeda Chemical Industries, Ltd. (JP) | 2000-01-26 | — | — | EP | disclosed |