Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 3/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 7/20 | 0.42 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | KDR | P35968 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | KIT | P10721 | 1/20 | 0.36 |
| ▸ | FLT1 | P17948 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2855459 | 0.87 | BRAF (0.57) | BRAFRAB9ANPC1KDRKMT2A | |
| SCHEMBL2854440 | 0.87 | ROCK2 (0.48) | BRAFROCK2RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL13185051 | 0.83 | ROCK2 (0.42) | BRAFROCK2KDRKMT2AMEN1 | |
| SCHEMBL3512390 | 0.83 | ROCK2 (0.42) | BRAFROCK2RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL2864471 | 0.83 | BRAF (0.37) | BRAFROCK2RAB9ANPC1KDR | |
| SCHEMBL2855597 | 0.83 | PCSK9 (0.48) | BRAFROCK2KDRPDGFRBKIT | |
| SCHEMBL2857499 | 0.81 | BRAF (0.42) | BRAFROCK2KDRKMT2AMEN1 | |
| SCHEMBL2858695 | 0.81 | BRAF (0.45) | BRAFROCK2KDRPDGFRBKIT | |
| SCHEMBL2862242 | 0.81 | BRAF (0.47) | BRAFRAB9ANPC1SMN1; SMN2KDR | |
| SCHEMBL2851337 | 0.81 | BRAF (0.50) | BRAFROCK2KDRKMT2AMEN1 |
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 |