Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MET | P08581 | 8/20 | 0.45 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.45 |
| ▸ | MAP3K1 | Q13233 | 1/20 | 0.45 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.45 |
| ▸ | Q6ZSR9 | Q6ZSR9 | 1/20 | 0.45 |
| ▸ | MAP4K5 | Q9Y4K4 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | MST1R | Q04912 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16615305 | 0.91 | KMT2A (0.40) | METMAP4K2MAP3K1AAK1Q6ZSR9 | |
| SCHEMBL16615101 | 0.80 | MET (0.46) | METMAP4K2MAP3K1AAK1Q6ZSR9 | |
| SCHEMBL17918726 | 0.80 | MET (0.54) | METMAP4K2MAP3K1AAK1Q6ZSR9 | |
| SCHEMBL20859323 | 0.80 | MET (0.44) | METMAP4K2MAP3K1AAK1Q6ZSR9 | |
| SCHEMBL17969736 | 0.76 | MET (0.43) | METMAP4K2MAP3K1AAK1Q6ZSR9 | |
| SCHEMBL17918857 | 0.75 | MET (0.50) | METMAP4K2MAP3K1AAK1Q6ZSR9 | |
| SCHEMBL16615213 | 0.73 | EPHX2 (0.43) | MAPTHPGDALDH1A1MEN1KMT2A | |
| SCHEMBL17918667 | 0.72 | MET (0.46) | METMAP4K2MAP3K1AAK1Q6ZSR9 | |
| SCHEMBL16615299 | 0.69 | POLB (0.41) | METMAP4K2MAP3K1AAK1Q6ZSR9 | |
| SCHEMBL20859457 | 0.69 | MET (0.42) | METMAP4K2MAP3K1AAK1Q6ZSR9 |
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-3050884-A1 | NOVEL CHEMICAL COMPOUNDS (VARIANTS) AND THE USE THEREOF TO TREAT ONCOLOGICAL DISEASES | Limited Liability Company "National Pharmaceutical (RU) | 2016-08-03 | — | — | EP | disclosed |
| WO-2015047133-A1 | NOVEL CHEMICAL COMPOUNDS (VARIANTS) AND THE USE THEREOF TO TREAT ONCOLOGICAL DISEASES | ОБЩЕСТВО С ОГРАНИЧЕННОЙ ОТВЕТСТВЕННОСТЬЮ "ОТЕЧЕСТВЕННЫЕ ФАРМАЦЕВТИЧЕСКИЕ ТЕХНОЛОГИИ" | 2015-04-02 | — | — | WO | disclosed |