Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | GSK3B | P49841 | 2/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11310955 | 0.75 | ALDH1A1 (0.51) | ALDH1A1MAPK1GSK3BHIF1ATRPA1 | |
| SCHEMBL5899564 | 0.75 | HSD11B1 (0.51) | ALDH1A1MAPK1GSK3BHIF1ATRPA1 | |
| SCHEMBL27596089 | 0.71 | MAPT (0.42) | ALDH1A1MAPK1GSK3BHIF1ATRPA1 | |
| SCHEMBL11288690 | 0.71 | GSK3B (0.62) | ALDH1A1MAPK1GSK3BHIF1ATRPA1 | |
| SCHEMBL754845 | 0.70 | ALDH1A1 (0.47) | ALDH1A1MAPK1GSK3BHIF1ATRPA1 | |
| SCHEMBL5899440 | 0.69 | TAS2R14 (0.63) | ALDH1A1MAPTKMT2AMEN1HSD11B1 | |
| SCHEMBL29443145 | 0.68 | ALDH1A1 (0.54) | ALDH1A1MAPK1GSK3BHIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL2314766 | 0.68 | ALDH1A1 (1.00) | ALDH1A1MAPK1GSK3BHIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL55444 | 0.68 | ALDH1A1 (1.00) | ALDH1A1MAPK1GSK3BHIF1ATRPA1 | |
| SCHEMBL11609924 | 0.68 | ALDH1A1 (0.51) | ALDH1A1MAPK1GSK3BHIF1ATRPA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100484928-C | thiadiazoline derivatives | KYOWA HAKKO KOGYO KK FUJI PHOT (JP) | 2009-05-06 | — | — | CN | disclosed |
| CN-1617864-A | thiadiazoline derivatives | KYOWA HAKKO KOGYO KK (JP) | 2005-05-18 | — | — | CN | disclosed |