Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | SLC1A1 | P43005 | 4/20 | 0.46 |
| ▸ | SLC1A3 | P43003 | 3/20 | 0.46 |
| ▸ | LTA4H | P09960 | 2/20 | 0.45 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.45 |
| ▸ | LAP3 | P28838 | 1/20 | 0.45 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MME | P08473 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7751248 | 0.88 | MME (0.53) | ALDH1A1IDO1KMT2AMAPK1L3MBTL1 | |
| SCHEMBL526075 | 0.88 | MME (0.53) | ALDH1A1IDO1KMT2AMAPK1L3MBTL1 | |
| SCHEMBL6777555 | 0.86 | IDO1 (0.44) | ALDH1A1IDO1KMT2AMAPK1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL28309990 | 0.86 | MME (0.52) | ALDH1A1IDO1KMT2AMAPK1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL28309991 | 0.86 | MME (0.52) | ALDH1A1IDO1KMT2AMAPK1L3MBTL1 | |
| SCHEMBL10441465 | 0.85 | IDO1 (0.53) | ALDH1A1IDO1KMT2AMAPK1L3MBTL1 | |
| SCHEMBL4161005 | 0.85 | IDO1 (0.53) | ALDH1A1IDO1KMT2AMAPK1L3MBTL1 | |
| SCHEMBL535584 | 0.83 | ALDH1A1 (0.50) | ALDH1A1IDO1KMT2AMAPK1L3MBTL1 | |
| SCHEMBL5019164 | 0.83 | ALDH1A1 (0.50) | ALDH1A1IDO1KMT2AMAPK1L3MBTL1 | |
| SCHEMBL22433276 | 0.83 | ALDH1A1 (0.50) | ALDH1A1IDO1KMT2AMAPK1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105601550-A | Stimulation sensitive multifunctional polyisocyanate with active groups | UNIV SICHUAN | 2016-05-25 | — | — | CN | disclosed |