Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 11/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.33 |
| ▸ | ITGAV | P06756 | 1/20 | 0.33 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.33 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.33 |
| ▸ | ITGB8 | P26012 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | JAK1 | P23458 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | CMA1 | P23946 | 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 | |
|---|---|---|---|---|
| SCHEMBL16623503 | 0.86 | EGFR (0.35) | EGFRPARP1JAK2JAK1 | |
| SCHEMBL16623565 | 0.85 | ALDH1A1 (0.41) | NPC1RAB9A | |
| SCHEMBL17849249 | 0.85 | EGFR (0.40) | EGFRJAK2JAK1 | |
| SCHEMBL18052623 | 0.85 | EGFR (0.36) | EGFRSCN9AJAK2JAK1RORC | |
| SCHEMBL17849188 | 0.83 | EGFR (0.40) | EGFRNPC1RAB9AJAK2JAK1 | |
| SCHEMBL16623493 | 0.83 | TYK2 (0.39) | JAK2JAK1 | |
| SCHEMBL17849212 | 0.83 | ITGB3 (0.37) | EIF2AK2ITGB3ITGB1ITGAVITGA5 | |
| SCHEMBL16623592 | 0.83 | EIF2AK2 (0.35) | EIF2AK2ITGB3ITGB1ITGAVITGA5 | |
| SCHEMBL16623558 | 0.80 | PARP1 (0.34) | PARP1 | |
| SCHEMBL16623594 | 0.79 | CMA1 (0.35) | EIF2AK2ITGB3ITGB1ITGAVITGA5 |
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 |
|---|---|---|---|---|---|---|---|
| US-9371320-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-06-21 | — | — | US | disclosed |
| US-9371320-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-06-21 | — | — | US | disclosed |