Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 16/20 | 0.44 |
| ▸ | CA2 | P00918 | 16/20 | 0.44 |
| ▸ | CA7 | P43166 | 16/20 | 0.44 |
| ▸ | CA9 | Q16790 | 16/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8571312 | 1.00 | CA1 (0.44) | CA1CA2CA7CA9 | |
| SCHEMBL8568640 | 0.88 | KMT2A (0.42) | — | |
| SCHEMBL8565777 | 0.88 | KMT2A (0.42) | — | |
| SCHEMBL8562292 | 0.82 | HDAC3 (0.53) | CA1CA2CA7CA9 | |
| SCHEMBL8563656 | 0.79 | ADRA1D (0.42) | — | |
| SCHEMBL8565543 | 0.78 | HTR2A (0.51) | CA1CA2CA7CA9 | |
| Hydrochloric Acid SCHEMBL8564995 | 0.78 | ADRA1D (0.41) | — | |
| Hydrochloric Acid SCHEMBL8564252 | 0.78 | ADRA1D (0.41) | — | |
| Hydrochloric Acid SCHEMBL8565379 | 0.78 | HTR2A (0.51) | CA1CA2CA7CA9 | |
| SCHEMBL8563145 | 0.75 | EPHX2 (0.51) | CA1CA2CA7CA9 |
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-0431943-B1 | Spiro(pyran)piperidine derivatives | MERCK & CO INC (US) | 1998-07-15 | — | — | EP | disclosed |
| US-5633247-A | ANTIARRTHYMIA AGENT | MERCK & CO., INC. (US) | 1997-05-27 | — | — | US | disclosed |
| US-5206240-A | Antiarrhythmia agents | MERCK & CO., INC. (US) | 1993-04-27 | — | — | US | disclosed |