Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | 0.84 | TP53 (0.47) | TP53MAPTHDAC1HDAC6HDAC2 | |
| SCHEMBL7019933 | 0.84 | HDAC1 (0.41) | TP53MAPTHDAC1HDAC6HDAC2 | |
| SCHEMBL7016308 | 0.82 | CYP19A1 (0.39) | TP53MAPTP2RX3RXFP1TSHR | |
| SCHEMBL7016306 | 0.82 | TP53 (0.35) | TP53MAPTHDAC1HDAC6HDAC2 | |
| Hydrochloric Acid SCHEMBL7012709 | 0.80 | SRC (0.37) | TP53MAPTHDAC1HDAC6HDAC2 | |
| SCHEMBL7015809 | 0.80 | HDAC6 (0.48) | TP53MAPTHDAC1HDAC6HDAC2 | |
| Hydrochloric Acid SCHEMBL7016878 | 0.80 | SRC (0.39) | TP53MAPTP2RX3RXFP1KDM4E | |
| Hydrochloric Acid SCHEMBL7016880 | 0.79 | SMN1; SMN2 (0.46) | MAPTHDAC1HDAC6HDAC2HDAC3 | |
| Hydrochloric Acid SCHEMBL7012711 | 0.78 | PSMB1 (0.49) | MAPTTHRBKDM4EALDH1A1TSHR | |
| SCHEMBL7015187 | 0.78 | RAB9A (0.37) | MAPTHDAC1HDAC2P2RX3TDP1 |
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 |