Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 5/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.41 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.41 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 2/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6867644 | 0.84 | MEN1 (0.43) | CYP11B2CYP11B1MEN1KMT2ACCNB2 | |
| SCHEMBL19509080 | 0.84 | CYP11B1 (0.43) | CYP11B2CYP11B1MEN1KMT2ACCNB2 | |
| SCHEMBL8972574 | 0.79 | CYP11B2 (0.36) | CYP11B2CYP11B1KDM1ACYP17A1RAB9A | |
| SCHEMBL8972569 | 0.79 | CYP11B2 (0.36) | CYP11B2CYP11B1KDM1ACYP17A1RAB9A | |
| SCHEMBL19850827 | 0.79 | CYP11B1 (0.47) | CYP11B2CYP11B1MEN1KMT2ACCNB2 | |
| SCHEMBL19824546 | 0.77 | CYP11B1 (0.43) | CYP11B2CYP11B1MEN1KMT2ACYP3A4 | |
| SCHEMBL20310639 | 0.77 | CYP11B1 (0.43) | CYP11B2CYP11B1MEN1KMT2ACYP3A4 | |
| SCHEMBL8972512 | 0.77 | CYP11B2 (0.33) | CYP11B2CYP11B1MEN1KMT2AKDM1A | |
| SCHEMBL9312426 | 0.77 | CYP11B2 (0.33) | CYP11B2CYP11B1MEN1KMT2AKDM1A | |
| SCHEMBL8972505 | 0.77 | CYP11B2 (0.33) | CYP11B2CYP11B1MEN1KMT2AKDM1A |
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-0433836-B1 | Halophenyl substituted dioxanes | HOFFMANN LA ROCHE (CH) | 1996-03-27 | — | — | EP | disclosed |
| US-5322638-A | Halophenyl substituted dioxanes | HOFFMANN-LA ROCHE INC. (US) | 1994-06-21 | — | — | US | disclosed |
| EP-0433836-A2 | Halophenyl substituted dioxanes | F. HOFFMANN-LA ROCHE AG (CH) | 1991-06-26 | — | — | EP | disclosed |