Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | TYK2 | P29597 | 1/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4611278 | 0.79 | ALDH1A1 (0.56) | KMT2AMEN1NPC1MAPTRAB9A | |
| SCHEMBL5230966 | 0.79 | SMN1; SMN2 (0.43) | KMT2AMEN1NPC1MAPTRAB9A | |
| SCHEMBL1831608 | 0.77 | MAPT (0.40) | KMT2AMEN1NPC1MAPTRAB9A | |
| SCHEMBL5670009 | 0.77 | RAB9A (0.61) | KMT2AMEN1NPC1MAPTRAB9A | |
| Hydrochloric Acid SCHEMBL18764850 | 0.75 | RAB9A (0.64) | KMT2AMEN1NPC1MAPTRAB9A | |
| Hydrochloric Acid SCHEMBL14844418 | 0.75 | RAB9A (0.64) | KMT2AMEN1NPC1MAPTRAB9A | |
| SCHEMBL1491324 | 0.69 | MGLL (0.46) | KMT2AMEN1NPC1RAB9ALOXL2 | |
| SCHEMBL6649427 | 0.68 | MEN1 (0.40) | KMT2AMEN1NPC1MAPTRAB9A | |
| SCHEMBL7983789 | 0.67 | LOXL2 (0.36) | MEN1LOXL2 | |
| SCHEMBL2674474 | 0.67 | — | — |
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-2011029832-A1 | NOVEL THIAZOL AND OXAZOL HEPCIDINE ANTAGONISTS | VIFOR (INTERNATIONAL) AG (CH) | 2011-03-17 | — | — | WO | disclosed |