Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| Dioxane SCHEMBL16737293 | 0.90 | SPHK1 (0.39) | SPHK1LMNATSHR | |
| Tetrahydrofuran SCHEMBL8082420 | 0.89 | ALDH1A1 (0.48) | ALDH1A1MEN1FAAHMAPK1KMT2A | |
| Hexane SCHEMBL3513719 | 0.87 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2ALMNATSHR | |
| Butyl Alcohol SCHEMBL7911002 | 0.87 | ALDH1A1 (0.46) | ALDH1A1MEN1FAAHMAPK1KMT2A | |
| Hexane SCHEMBL224276 | 0.87 | ALDH1A1 (0.53) | ALDH1A1MEN1KMT2ALMNATSHR | |
| Hexane SCHEMBL5237862 | 0.87 | ALDH1A1 (0.53) | ALDH1A1MEN1KMT2ALMNATSHR | |
| Hexane SCHEMBL22134480 | 0.87 | ALDH1A1 (0.53) | ALDH1A1MEN1KMT2ALMNATSHR | |
| Hexane SCHEMBL14895621 | 0.87 | ALDH1A1 (0.53) | ALDH1A1MEN1KMT2ALMNATSHR | |
| Hexane SCHEMBL8134718 | 0.85 | SPHK1 (0.37) | MEN1FAAHMAPK1KMT2ASPHK1 | |
| Heptane SCHEMBL21580605 | 0.84 | TSHR (0.44) | ALDH1A1MEN1KMT2ALMNATSHR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100230339-A1 | Particulate chiral separation material | EVOLVED NANOMATERIAL SCIENCES, INC. (US) | 2010-09-16 | — | — | US | disclosed |
| EP-1979090-A1 | PARTICULATE CHIRAL SEPARATION MATERIAL | EVOLVED NANOMATERIAL SCIENCES, INC. (US) | 2008-10-15 | — | — | EP | disclosed |
| WO-2007075608-A1 | PARTICULATE CHIRAL SEPARATION MATERIAL | EVOLVED NANOMATERIAL SCIENCES, INC. (US) | 2007-07-05 | — | — | WO | disclosed |
| US-5189177-A | Chiral boron catalysts for reduction of ketones and process for their preparation | MERCK & CO., INC. (US) | 1993-02-23 | — | — | US | disclosed |
| EP-0453298-A2 | Chiral catalysts for reduction of ketones and process for their preparation | MERCK & CO. INC. (US) | 1991-10-23 | — | — | EP | disclosed |