Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | FBP1 | P09467 | 8/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2548348 | 0.81 | STAT3 (0.43) | KMT2AKDM4ECYP1A2ALDH1A1GAA | |
| SCHEMBL8462493 | 0.81 | KMT2A (0.47) | KMT2AFBP1KDM4EF2HTR6 | |
| SCHEMBL2548351 | 0.81 | STAT3 (0.43) | KMT2AKDM4ECYP1A2ALDH1A1GAA | |
| SCHEMBL4621606 | 0.81 | STAT3 (0.43) | KMT2AKDM4ECYP1A2ALDH1A1GAA | |
| SCHEMBL476991 | 0.81 | CYP1A2 (0.41) | KMT2ATSHRMAPK1KDM4ECYP1A2 | |
| SCHEMBL1832458 | 0.78 | KMT2A (0.47) | KMT2AFBP1F2HTR6ALDH1A1 | |
| SCHEMBL27583915 | 0.78 | PRMT5 (0.56) | KMT2AF2ALDH1A1GAAMEN1 | |
| Acetone SCHEMBL8568091 | 0.78 | STAT3 (0.43) | KMT2AKDM4ECYP1A2ALDH1A1GAA | |
| Acetone SCHEMBL9451549 | 0.78 | STAT3 (0.43) | KMT2AKDM4ECYP1A2ALDH1A1GAA | |
| Acetone SCHEMBL8766802 | 0.78 | STAT3 (0.43) | KMT2AKDM4ECYP1A2ALDH1A1GAA |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6166018-A | 2R, 4S, R, S- and 2S, 4R, R, S-hydroxyitraconazole | SEPRACOR INC. (US) | 2000-12-26 | — | — | US | disclosed |
| US-6147077-A | FUNGICIDE | SEPRACOR INC. (US) | 2000-11-14 | — | — | US | disclosed |
| EP-0942907-A1 | 2R, 4S, S, R- AND 2S, 4R, S, R-HYDROXYITRACONAZOLE | SEPRACOR, INC. (US) | 1999-09-22 | — | — | EP | disclosed |
| US-5952502-A | ADMINISTERING TO THE MAMMAL A DIOXOLANE COMPOUND FOR FUNGAL TREATMENT | SEPRACOR INC. (US) | 1999-09-14 | — | — | US | disclosed |
| EP-0938487-A2 | 2$i(R),4$i(S),$i(R),$i(S)- AND 2$i(S),4$i(R),$i(R),$i(S)-HYDROXYITRACONAZOLE- AND HYDROXYSAPERCONAZOLE DERIVATIVES | SEPRACOR, INC. (US) | 1999-09-01 | — | — | EP | disclosed |
| WO-1998021213-A2 | 2R,4S,R,S- AND 2S,4R,R,S-HYDROXYITRACONAZOLE- AND HYDROXYSAPERCONAZOLE DERIVATIVES | SEPRACOR, INC. (US) | 1998-05-22 | — | — | WO | disclosed |
| WO-1998021203-A1 | 2R,4S,S,R- AND 2S,4R,S,R-HYDROXYITRACONAZOLE | SEPRACOR, INC. (US) | 1998-05-22 | — | — | WO | disclosed |