Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 10/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 7/20 | 0.37 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.36 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 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 | |
|---|---|---|---|---|
| SCHEMBL8076680 | 0.86 | CYP11B1 (0.49) | CYP11B1CYP11B2SIGMAR1CYP19A1CFTR | |
| SCHEMBL6502210 | 0.83 | CYP11B1 (0.46) | CYP11B1CYP11B2SIGMAR1CYP19A1CFTR | |
| Bromide SCHEMBL8069043 | 0.82 | CYP11B1 (0.44) | CYP11B1CYP11B2SIGMAR1CYP19A1CFTR | |
| SCHEMBL28307922 | 0.75 | CFTR (0.57) | CYP11B1CYP11B2CYP19A1CFTRSLC6A2 | |
| SCHEMBL30440878 | 0.74 | SLC6A2 (0.46) | CYP19A1CFTRSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL29029201 | 0.68 | ADRA2A (0.35) | SMN1; SMN2CYP3A4 | |
| SCHEMBL30491128 | 0.68 | ADRA2A (0.35) | SMN1; SMN2CYP3A4 | |
| SCHEMBL29029204 | 0.68 | ADRA2A (0.35) | SMN1; SMN2CYP3A4 | |
| SCHEMBL6962168 | 0.67 | CYP11B1 (0.46) | CYP11B1CYP11B2SMN1; SMN2 | |
| SCHEMBL7145516 | 0.67 | CYP11B1 (0.46) | CYP11B1CYP11B2 |
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 |