Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 4/20 | 0.48 |
| ▸ | KDR | P35968 | 4/20 | 0.48 |
| ▸ | DYRK1A | Q13627 | 9/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.38 |
| ▸ | AKT1 | P31749 | 2/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.37 |
| ▸ | RAF1 | P04049 | 1/20 | 0.37 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.37 |
| ▸ | KIT | P10721 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.37 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.37 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.37 |
| ▸ | TEK | Q02763 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.37 |
| ▸ | FSCN1 | Q16658 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2858177 | 0.86 | KDR (0.35) | BRAFKDRPIK3CAIKBKBRAF1 | |
| SCHEMBL2851100 | 0.86 | BRAF (0.42) | BRAFKDRDYRK1APDPK1PIK3CA | |
| SCHEMBL3510286 | 0.83 | BRAF (0.42) | BRAFKDRDYRK1APDPK1PIK3CA | |
| SCHEMBL13185059 | 0.81 | BRAF (0.56) | BRAFKDRPIK3CAAKT1IKBKB | |
| SCHEMBL2861355 | 0.80 | BRAF (0.57) | BRAFKDRPIK3CAIKBKBRAF1 | |
| SCHEMBL2853575 | 0.80 | BRAF (0.62) | BRAFKDRIKBKBRAF1ERBB2 | |
| SCHEMBL13184956 | 0.80 | BRAF (0.53) | BRAFKDRPIK3CAAKT1IKBKB | |
| SCHEMBL2853884 | 0.78 | KDR (0.63) | BRAFKDRDYRK1APIK3CAAKT1 | |
| SCHEMBL2861950 | 0.77 | BRAF (0.61) | BRAFKDRPIK3CAAKT1IKBKB | |
| SCHEMBL14406900 | 0.77 | KDR (0.56) | BRAFKDRPIK3CAAKT1IKBKB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2184285-B1 | HETEROCYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2015-11-04 | — | — | EP | disclosed |
| EP-2184285-A1 | HETEROCYCLIC COMPOUND AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2010-05-12 | — | — | EP | disclosed |