Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CACNA1S | Q13698 | 10/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.35 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | HRH2 | P25021 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | SCN1A | P35498 | 1/20 | 0.35 |
| ▸ | SCN4A | P35499 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7377505 | 0.95 | KDM4E (0.46) | KDM4ETP53MAPK1CACNA1SHTR2A | |
| Hydrochloric Acid SCHEMBL7768556 | 0.84 | TP53 (0.44) | KDM4ETP53MAPK1CACNA1SHTR2A | |
| SCHEMBL7370521 | 0.83 | KDM4E (0.45) | KDM4ETP53MAPK1CACNA1SHTR2A | |
| SCHEMBL7379320 | 0.81 | KDM4E (0.41) | KDM4ETP53MAPK1CACNA1SHTR2A | |
| SCHEMBL7285664 | 0.75 | KDM4E (0.39) | KDM4ETP53MAPK1CACNA1SHTR2A | |
| SCHEMBL7287193 | 0.72 | KDM4E (0.39) | KDM4ETP53MAPK1CACNA1SHTR2A | |
| SCHEMBL8441649 | 0.70 | KDM4E (0.56) | KDM4ETP53MAPK1CACNA1SHTR2A | |
| Hydrochloric Acid SCHEMBL11369212 | 0.69 | KDM4E (0.55) | KDM4ETP53MAPK1CACNA1SHTR2A | |
| SCHEMBL10586683 | 0.66 | DRD3 (0.40) | KDM4ETP53MAPK1CACNA1SHTR2A | |
| SCHEMBL7292992 | 0.66 | CACNA1S (0.84) | CACNA1SCYP3A4TSHRABCB11LMNA |
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-0353032-A1 | 1,5-benzothiazepine derivatives, their preparation and their use in the treatment of cardiovascular disorders | Sankyo Company Limited (JP) | 1990-01-31 | — | — | EP | disclosed |