Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.35 |
| ▸ | CMA1 | P23946 | 6/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.32 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.32 |
| ▸ | ITGAV | P06756 | 1/20 | 0.32 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.32 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.32 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.32 |
| ▸ | ITGB8 | P26012 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 2/20 | 0.32 |
| ▸ | TDO2 | P48775 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16623594 | 0.96 | CMA1 (0.35) | EIF2AK2CMA1NPC1RAB9AF10 | |
| SCHEMBL17849212 | 0.89 | ITGB3 (0.37) | EIF2AK2CMA1NPC1RAB9AF10 | |
| SCHEMBL17849219 | 0.84 | RAF1 (0.42) | NPC1RAB9AMEN1KMT2A | |
| SCHEMBL17849221 | 0.83 | EIF2AK2 (0.34) | EIF2AK2CMA1NPC1RAB9AHCRTR1 | |
| SCHEMBL17849193 | 0.75 | F10 (0.43) | NPC1RAB9AF10LMNA | |
| SCHEMBL16623554 | 0.75 | MAPK14 (0.33) | F10KMT2A | |
| SCHEMBL16623479 | 0.74 | CRBN (0.40) | EIF2AK2CMA1 | |
| SCHEMBL16623587 | 0.73 | ROCK1 (0.39) | NPC1RAB9A | |
| SCHEMBL16623480 | 0.73 | MAPK14 (0.34) | F10RORCKMT2A | |
| SCHEMBL17849207 | 0.72 | ROCK1 (0.39) | NPC1RAB9AMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2857400-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2015-04-08 | — | — | EP | disclosed |