Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.65 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.49 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.49 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 2/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.31 |
| ▸ | PDK4 | Q16654 | 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 | |
|---|---|---|---|---|
| SCHEMBL9670822 | 1.00 | KCNH2 (0.65) | KCNH2PDE3BPDE3AGPR119MEN1 | |
| Hydrochloric Acid SCHEMBL9638636 | 0.93 | KCNH2 (0.57) | KCNH2PDE3BPDE3AGPR119MEN1 | |
| SCHEMBL9638453 | 0.93 | KCNH2 (0.56) | KCNH2PDE3BPDE3AGPR119MEN1 | |
| SCHEMBL9638449 | 0.93 | KCNH2 (0.56) | KCNH2PDE3BPDE3AGPR119MEN1 | |
| SCHEMBL9639276 | 0.91 | KCNH2 (0.78) | KCNH2PDE3BPDE3AMEN1KMT2A | |
| SCHEMBL9639280 | 0.91 | KCNH2 (0.78) | KCNH2PDE3BPDE3AMEN1KMT2A | |
| SCHEMBL9638262 | 0.91 | KCNH2 (0.54) | KCNH2PDE3BPDE3AGPR119MEN1 | |
| SCHEMBL9638268 | 0.91 | KCNH2 (0.54) | KCNH2PDE3BPDE3AGPR119MEN1 | |
| SCHEMBL9638097 | 0.88 | KCNH2 (0.52) | KCNH2PDE3BPDE3AGPR119MEN1 | |
| SCHEMBL9639318 | 0.88 | PDE3B (0.51) | KCNH2PDE3BPDE3AGPR119MEN1 |
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-0492257-A1 | Thiadiazinone derivatives | MERCK PATENT GmbH (DE) | 1992-07-01 | — | — | EP | disclosed |