Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 6/20 | 0.35 |
| ▸ | MAPT | P10636 | 6/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7017888 | 0.77 | TP53 (0.47) | TP53MAPTTDP1RXFP1THRB | |
| Hydrochloric Acid SCHEMBL7012717 | 0.73 | MAPT (0.39) | TP53MAPTTDP1RXFP1THRB | |
| SCHEMBL7012596 | 0.72 | TDP1 (0.48) | MAPTTDP1EPHX2NR1H4ALDH1A1 | |
| SCHEMBL7016306 | 0.72 | TP53 (0.35) | TP53MAPTTDP1RXFP1THRB | |
| SCHEMBL7016308 | 0.72 | CYP19A1 (0.39) | TP53MAPTRXFP1TSHR | |
| SCHEMBL7014404 | 0.70 | TP53 (0.46) | TP53MAPTTDP1RXFP1THRB | |
| Hydrochloric Acid SCHEMBL7012711 | 0.69 | PSMB1 (0.49) | MAPTTHRBALDH1A1KDM4ETSHR | |
| Hydrochloric Acid SCHEMBL7012709 | 0.69 | SRC (0.37) | TP53MAPTTDP1RXFP1HDAC4 | |
| SCHEMBL7019303 | 0.68 | TP53 (0.46) | TP53MAPTTDP1RXFP1THRB | |
| SCHEMBL7015187 | 0.68 | RAB9A (0.37) | MAPTTDP1HDAC1ALDH1A1GAA |
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 |