Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | HRH2 | P25021 | 2/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9147554 | 0.87 | HRH4 (0.43) | CYP3A4CYP2C9ALDH1A1CYP2C19CYP1A2 | |
| SCHEMBL9148290 | 0.86 | HRH4 (0.41) | CYP3A4CYP2C9ALDH1A1CYP2C19CYP1A2 | |
| SCHEMBL9147482 | 0.84 | BCL6 (0.53) | CYP3A4ALDH1A1CYP1A2HRH2HRH4 | |
| SCHEMBL8620022 | 0.82 | HRH4 (0.40) | CYP3A4CYP2C9ALDH1A1CYP2C19CYP1A2 | |
| SCHEMBL7359999 | 0.80 | P2RX7 (0.52) | CYP3A4CYP2C9ALDH1A1CYP2C19CYP1A2 | |
| SCHEMBL17117350 | 0.79 | ALDH1A1 (0.70) | CYP3A4CYP2C9ALDH1A1CYP2C19CYP1A2 | |
| SCHEMBL7424829 | 0.78 | HRH4 (0.53) | HRH2HRH4NAMPT | |
| SCHEMBL7353949 | 0.77 | HRH4 (0.42) | HRH2HRH4ROCK2KMT2AKDM4E | |
| SCHEMBL7430606 | 0.77 | POLB (0.53) | HRH2HRH4SMN1; SMN2ROCK2CNR1 | |
| SCHEMBL9149002 | 0.77 | BCL6 (0.62) | CYP3A4CYP1A2HRH4LMNASMN1; SMN2 |
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-0741708-A1 | CYANOGUANIDINES AS K-CHANNEL BLOCKERS | PHARMACIA & UPJOHN COMPANY (US) | 1996-11-13 | — | — | EP | disclosed |
| WO-1995020579-A1 | CYANOGUANIDINES AS K-CHANNEL BLOCKERS | PHARMACIA & UPJOHN COMPANY (US) | 1995-08-03 | — | — | WO | disclosed |