Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 6/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.45 |
| ▸ | HTR3A | P46098 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | UBE2N | P61088 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23048624 | 0.85 | DYRK1A (0.39) | HRH4HRH3CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL19546591 | 0.83 | HRH4 (0.56) | HRH4HRH3HTR3AKDM4ERAD52 | |
| SCHEMBL19547056 | 0.81 | HRH4 (0.55) | HRH4HRH3HTR3AKDM4ERAD52 | |
| SCHEMBL23916158 | 0.80 | HRH4 (0.54) | HRH4HRH3HTR3AKDM4ERAD52 | |
| SCHEMBL27827453 | 0.80 | HRH4 (0.54) | HRH4HRH3HTR3AKDM4ERAD52 | |
| SCHEMBL23916096 | 0.80 | HRH4 (0.54) | HRH4HRH3HTR3AKDM4ERAD52 | |
| SCHEMBL23048862 | 0.75 | HRH3 (0.40) | HRH4HRH3 | |
| SCHEMBL10196855 | 0.74 | HRH4 (0.61) | HRH4HRH3HTR3AKDM4ERAD52 | |
| SCHEMBL23048716 | 0.73 | KDM4E (0.32) | KDM4E | |
| SCHEMBL568726 | 0.72 | HRH4 (0.46) | HRH4HRH3HTR3AKDM4ERAD52 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3448386-B1 | ISOQUINOLIN-3-YL CARBOXAMIDES AND PREPARATION AND USE THEREOF | SAMUMED LLC (US) | 2021-03-03 | — | — | EP | disclosed |