Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 11/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.36 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PDE1A | P54750 | 1/20 | 0.36 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20176799 | 0.81 | KCNJ1 (0.68) | KCNJ1KCNH2 | |
| SCHEMBL20168410 | 0.77 | KCNJ1 (0.44) | KCNJ1KCNH2LMNAGAAMAPT | |
| SCHEMBL4110681 | 0.75 | KDM4E (0.57) | KCNJ1LMNAMAPTPDE1APDE1B | |
| SCHEMBL20168614 | 0.75 | KCNJ1 (0.50) | KCNJ1KCNH2 | |
| SCHEMBL20176944 | 0.75 | KCNJ1 (0.50) | KCNJ1KCNH2 | |
| SCHEMBL30751840 | 0.74 | KCNJ1 (0.44) | KCNJ1KCNH2LMNAPDE1APDE1B | |
| SCHEMBL286730 | 0.74 | KCNJ1 (0.44) | KCNJ1KCNH2LMNAPDE1APDE1B | |
| SCHEMBL20176843 | 0.71 | KCNJ1 (0.41) | KCNJ1KCNH2IMPDH2IMPDH1LMNA | |
| SCHEMBL16836077 | 0.71 | KCNJ1 (0.62) | KCNJ1KCNH2 | |
| SCHEMBL286450 | 0.71 | KCNJ1 (0.51) | KCNJ1KCNH2LMNAPDE1APDE1B |
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-3535258-B1 | SUBSTITUTED BICYCLE HETEROCYCLIC DERIVATIVES USEFUL AS ROMK CHANNEL INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2021-11-24 | — | — | EP | disclosed |
| WO-2018093569-A1 | SUBSTITUTED BICYCLE HETEROCYCLIC DERIVATIVES USEFUL AS ROMK CHANNEL INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-05-24 | — | — | WO | disclosed |