Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 3/20 | 0.49 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.49 |
| ▸ | KIT | P10721 | 1/20 | 0.49 |
| ▸ | FLT1 | P17948 | 1/20 | 0.49 |
| ▸ | BRAF | P15056 | 2/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 5/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
| ▸ | FSCN1 | Q16658 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12334323 | 1.00 | KDR (0.49) | KDRPDGFRBKITFLT1BRAF | |
| SCHEMBL2452626 | 0.92 | KDR (0.47) | KDRPDGFRBKITFLT1BRAF | |
| SCHEMBL2452624 | 0.92 | KDR (0.47) | KDRPDGFRBKITFLT1BRAF | |
| SCHEMBL2860133 | 0.87 | KDR (0.55) | KDRPDGFRBKITFLT1BRAF | |
| SCHEMBL2450603 | 0.87 | KDR (0.55) | KDRPDGFRBKITFLT1BRAF | |
| SCHEMBL13293976 | 0.86 | KDR (0.57) | KDRPDGFRBKITFLT1BRAF | |
| SCHEMBL12334321 | 0.84 | KDR (0.51) | KDRPDGFRBKITFLT1BRAF | |
| SCHEMBL2453000 | 0.83 | KDR (0.52) | KDRPDGFRBKITFLT1BRAF | |
| SCHEMBL2452680 | 0.82 | KDR (0.49) | KDRPDGFRBKITFLT1BRAF | |
| SCHEMBL2456171 | 0.82 | KDR (0.49) | KDRPDGFRBKITFLT1BRAF |
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-2399921-B1 | HETEROCYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2015-08-12 | — | — | EP | disclosed |
| EP-2399921-A1 | HETEROCYCLIC COMPOUND AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2011-12-28 | — | — | EP | disclosed |