Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PDE1B | Q01064 | 8/20 | 0.43 |
| ▸ | PDE1A | P54750 | 7/20 | 0.43 |
| ▸ | PDE1C | Q14123 | 7/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.41 |
| ▸ | VNN1 | O95497 | 2/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 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 | |
|---|---|---|---|---|
| SCHEMBL7020546 | 0.88 | MAPT (0.41) | TP53MAPTHDAC1HDAC8HDAC6 | |
| SCHEMBL7015600 | 0.87 | MAPT (0.43) | TP53MAPTMEN1KMT2A | |
| SCHEMBL7019092 | 0.80 | MAPT (0.41) | TP53MAPTHDAC1HDAC8HDAC6 | |
| SCHEMBL7019042 | 0.72 | KAT2B (0.46) | TP53MAPTHDAC1HDAC8HDAC6 | |
| SCHEMBL7010725 | 0.70 | NPC1 (0.42) | MAPTHDAC1HDAC8HDAC6NPBWR1 | |
| SCHEMBL14971734 | 0.67 | HPGD (0.54) | CYP19A1TP53MAPTGLAGAA | |
| SCHEMBL7010653 | 0.65 | PKM (0.45) | TP53MAPTNPBWR1VNN1 | |
| SCHEMBL28232519 | 0.64 | RAB9A (0.63) | CYP19A1MAPTGAAVNN1MEN1 | |
| SCHEMBL24687649 | 0.63 | NPBWR1 (0.75) | NPBWR1MCHR1 | |
| SCHEMBL19458501 | 0.63 | PDE1B (0.56) | MAPTPDE1BPDE1APDE1CNPBWR1 |
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-0733633-B1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-05-28 | — | — | EP | disclosed |
| EP-0733633-A1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-09-25 | — | — | EP | disclosed |