Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 6/20 | 0.44 |
| ▸ | ELANE | P08246 | 6/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL24135530 | 0.85 | KCNJ1 (0.45) | KCNJ1ELANEALKBH1 | |
| SCHEMBL20177107 | 0.77 | KCNJ1 (0.47) | KCNJ1ELANEALDH1A1 | |
| SCHEMBL24135531 | 0.75 | KCNJ1 (0.44) | KCNJ1ALDH1A1 | |
| SCHEMBL21850933 | 0.69 | KCNJ1 (0.45) | KCNJ1 | |
| SCHEMBL20177186 | 0.65 | KCNJ1 (0.47) | KCNJ1ELANEALDH1A1 | |
| SCHEMBL26795545 | 0.64 | ELANE (0.36) | ELANEALKBH1ALDH1A1 | |
| SCHEMBL30908441 | 0.62 | XDH (0.46) | ALDH1A1 | |
| SCHEMBL16635546 | 0.60 | TRPA1 (0.43) | — | |
| SCHEMBL30908493 | 0.60 | MAPK1 (0.40) | MAPTALDH1A1 | |
| SCHEMBL20574835 | 0.59 | KCNJ1 (0.43) | KCNJ1ALKBH1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018093569-A1 | SUBSTITUTED BICYCLE HETEROCYCLIC DERIVATIVES USEFUL AS ROMK CHANNEL INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-05-24 | — | — | WO | disclosed |