Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.49 |
| ▸ | CFTR | P13569 | 2/20 | 0.48 |
| ▸ | LTA4H | P09960 | 1/20 | 0.48 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.47 |
| ▸ | CTSS | P25774 | 2/20 | 0.47 |
| ▸ | CTSK | P43235 | 1/20 | 0.47 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.46 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.46 |
| ▸ | ITGAL | P20701 | 1/20 | 0.46 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.44 |
| ▸ | VCP | P55072 | 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 | |
|---|---|---|---|---|
| SCHEMBL1198302 | 0.86 | MEN1 (0.52) | ARALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL16217975 | 0.86 | MEN1 (0.52) | ARALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL1197815 | 0.86 | SCN9A (0.59) | ARALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL1198026 | 0.86 | MEN1 (0.52) | ARALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL17887305 | 0.82 | CTSS (0.52) | ARALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL12890305 | 0.82 | ALDH1A1 (0.50) | ARALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL13140240 | 0.82 | L3MBTL1 (0.60) | ALDH1A1MEN1KMT2AKDM4ELTA4H | |
| Hydrochloric Acid SCHEMBL1198916 | 0.81 | ALDH1A1 (0.49) | ARALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL2405752 | 0.81 | RECQL (0.60) | ARALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL1198896 | 0.79 | ALDH1A1 (0.56) | ARALDH1A1MEN1KMT2AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009123316-A1 | HETEROCYCLIC DERIVATIVE AND USE THEREOF | 武田薬品工業株式会社 (JP) | 2009-10-08 | — | — | WO | disclosed |