Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | ATM | Q13315 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | CA12 | O43570 | 2/20 | 0.54 |
| ▸ | CA1 | P00915 | 2/20 | 0.54 |
| ▸ | CA2 | P00918 | 2/20 | 0.54 |
| ▸ | CA9 | Q16790 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | STAT3 | P40763 | 1/20 | 0.51 |
| ▸ | CA5A | P35218 | 1/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.51 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9828864 | 1.00 | KCNH2 (0.61) | KCNH2POLBATMMAPTKMT2A | |
| SCHEMBL9829336 | 0.91 | POLB (0.53) | KCNH2POLBATMMAPTKMT2A | |
| Hydrochloric Acid SCHEMBL9829893 | 0.90 | POLB (0.51) | KCNH2POLBATMMAPTKMT2A | |
| SCHEMBL1969068 | 0.84 | ATM (0.67) | KCNH2POLBATMMAPTKMT2A | |
| SCHEMBL9160396 | 0.82 | KCNH2 (0.58) | KCNH2POLBATMMAPTKMT2A | |
| SCHEMBL9160205 | 0.82 | ATM (0.59) | KCNH2POLBATMMAPTKMT2A | |
| SCHEMBL22192868 | 0.82 | LMNA (0.67) | KCNH2POLBATMMAPTKMT2A | |
| SCHEMBL6093694 | 0.81 | SIGMAR1 (0.65) | KCNH2POLBATMADRB2ALDH1A1 | |
| SCHEMBL6094958 | 0.81 | SIGMAR1 (0.65) | KCNH2POLBATMADRB2ALDH1A1 | |
| SCHEMBL9164083 | 0.80 | HTT (0.78) | KCNH2POLBATMMAPTKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0256888-B1 | BENZOTHIAZEPINE VASODILATORS HAVING ARALKYL SUBSTITUTION | McNeilab, Inc. (US) | 1991-07-03 | — | — | EP | disclosed |
| US-4729994-A | Benzothiazepine vasodilators having aralkyl substitution | MCNEILAB, INC. (US) | 1988-03-08 | — | — | US | disclosed |
| EP-0256888-A1 | Benzothiazepine vasodilators having aralkyl substitution | McNeilab, Inc. (US) | 1988-02-24 | — | — | EP | disclosed |