Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.45 |
| ▸ | MEN1 | O00255 | 5/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | LTC4S | Q16873 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18568721 | 0.88 | KDM4E (0.42) | NPC1MAPTALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL18568837 | 0.86 | RAB9A (0.42) | NPSR1KMT2AMEN1NPC1POLB | |
| SCHEMBL18568917 | 0.84 | NUDT1 (0.33) | NPC1POLBMAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL18568874 | 0.82 | NPSR1 (0.41) | NPSR1KMT2AMEN1NPC1POLB | |
| SCHEMBL13672592 | 0.82 | KMT2A (0.46) | NPSR1KMT2AMEN1NPC1POLB | |
| SCHEMBL18568895 | 0.81 | CCR4 (0.33) | MAPTALDH1A1KDM4EGAA | |
| SCHEMBL18569096 | 0.80 | KDM4E (0.51) | NPSR1KMT2AMEN1NPC1MAPT | |
| SCHEMBL18568998 | 0.79 | KDM4E (0.44) | KMT2AMEN1NPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL12784632 | 0.76 | ALDH1A1 (0.51) | NPSR1KMT2AMEN1NPC1POLB | |
| SCHEMBL18568990 | 0.75 | KDM4E (0.47) | NPSR1KMT2AMEN1NPC1POLB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2308839-B1 | FUSED HETEROCYCLIC COMPOUNDS | TAKEDA PHARMACEUTICALS CO (JP) | 2017-03-01 | — | — | EP | disclosed |