Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 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 | |
|---|---|---|---|---|
| SCHEMBL28358804 | 0.77 | CYP4F2 (0.41) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL18654174 | 0.74 | ALDH1A1 (0.46) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL2171302 | 0.74 | ALDH1A1 (0.46) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL1396425 | 0.74 | ALDH1A1 (0.46) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL2316349 | 0.72 | MMP8 (0.47) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL28869251 | 0.72 | ALDH1A1 (0.44) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL12386545 | 0.72 | CYP4F2 (0.44) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL556528 | 0.72 | ALDH1A1 (0.48) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL2242736 | 0.72 | CYP4F2 (0.44) | ALDH1A1LMNAHSD17B10PKMKDM4E | |
| SCHEMBL8360055 | 0.71 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3541882-A1 | DISPERSIONS OF -KETOCARBONYL-FUNCTIONAL ORGANOSILICON COMPOUNDS | Wacker Chemie AG (DE) | 2019-09-25 | — | — | EP | disclosed |
| EP-3541986-A1 | COMPOSITIONS CONTAINING BETA-KETOCARBONYL-FUNCTIONAL ORGANOSILICON COMPOUNDS | Wacker Chemie AG (DE) | 2019-09-25 | — | — | EP | disclosed |